sodium 2,4-bis(azanyl)-N-[6-[[3-ethanoyl-10-methoxy-3,5,12-tris(oxidanyl)-6,11-bis(oxidanylidene)-2,4-dihydro-1H-tetracen-1-yl]oxy]-2-methyl-3-oxidanyl-oxan-4-yl]butanamide chloride

Systemtic Name: sodium 2,4-bis(azanyl)-N-[6-[[3-ethanoyl-10-methoxy-3,5,12-tris(oxidanyl)-6,11-bis(oxidanylidene)-2,4-dihydro-1H-tetracen-1-yl]oxy]-2-methyl-3-oxidanyl-oxan-4-yl]butanamide chloride Openeye Name: sodium N-[6-[(3-acetyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl)oxy]-3-hydroxy-2-methyl-tetrahydropyran-4-yl]-2,4-diamino-butanamide chloride CAS Name: sodium N-[6-[(3-acetyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl)oxy]-3-hydroxy-2-methyl-4-oxanyl]-2,4-diaminobutanamide chloride IUPAC Name: sodium N-[6-[(3-acetyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl)oxy]-3-hydroxy-2-methyloxan-4-yl]-2,4-diaminobutanamide chloride Traditional Name: sodium N-[6-[(3-acetyl-3,5,12-trihydroxy-6,11-diketo-10-methoxy-2,4-dihydro-1H-tetracen-1-yl)oxy]-3-hydroxy-2-methyl-tetrahydropyran-4-yl]-2,4-diamino-butyramide chloride Formula: C31H37ClN3NaO11 MolecularWeight: 686.08175

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(CC(O1)OC2CC(CC3=C(C4=C(C(=C23)O)C(=O)C5=C(C4=O)C=CC=C5OC)O)(C(=O)C)O)NC(=O)C(CCN)N)O.[Na+].[Cl-]

Isomeric SMILES

CC1C(C(CC(O1)OC2CC(CC3=C(C4=C(C(=C23)O)C(=O)C5=C(C4=O)C=CC=C5OC)O)(C(=O)C)O)NC(=O)C(CCN)N)O.[Na+].[Cl-]

InChI

InChI=1S/C31H37N3O11.ClH.Na/c1-12-25(36)17(34-30(41)16(33)7-8-32)9-20(44-12)45-19-11-31(42,13(2)35)10-15-22(19)29(40)24-23(27(15)38)26(37)14-5-4-6-18(43-3)21(14)28(24)39;;/h4-6,12,16-17,19-20,25,36,38,40,42H,7-11,32-33H2,1-3H3,(H,34,41);1H;/q;;+1/p-1