2-[[(E)-[10,11,12a-tris(oxidanyl)-1,3,12-tris(oxidanylidene)-4a,5,5a,6-tetrahydro-4H-tetracen-2-ylidene]-oxidanyl-methyl]-azanyl-amino]-N-prop-2-enyl-ethanamide

Systemtic Name: 2-[[(E)-[10,11,12a-tris(oxidanyl)-1,3,12-tris(oxidanylidene)-4a,5,5a,6-tetrahydro-4H-tetracen-2-ylidene]-oxidanyl-methyl]-azanyl-amino]-N-prop-2-enyl-ethanamide Openeye Name: N-allyl-2-[amino-[(E)-(10,11,12a-trihydroxy-1,3,12-trioxo-4a,5,5a,6-tetrahydro-4H-tetracen-2-ylidene)-hydroxy-methyl]amino]acetamide CAS Name: 2-[amino-[(E)-(10,11,12a-trihydroxy-1,3,12-trioxo-4a,5,5a,6-tetrahydro-4H-tetracen-2-ylidene)-hydroxymethyl]amino]-N-prop-2-enylacetamide IUPAC Name: 2-[amino-[(E)-(10,11,12a-trihydroxy-1,3,12-trioxo-4a,5,5a,6-tetrahydro-4H-tetracen-2-ylidene)-hydroxymethyl]amino]-N-prop-2-enylacetamide Traditional Name: N-allyl-2-[amino-[(E)-(10,11,12a-trihydroxy-1,3,12-triketo-4a,5,5a,6-tetrahydro-4H-tetracen-2-ylidene)-hydroxy-methyl]amino]acetamide Formula: C24H25N3O8 MolecularWeight: 483.4706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)CN(C(=C1C(=O)CC2CC3CC4=C(C(=CC=C4)O)C(=C3C(=O)C2(C1=O)O)O)O)N

Isomeric SMILES

C=CCNC(=O)CN(/C(=C\1/C(=O)CC2CC3CC4=C(C(=CC=C4)O)C(=C3C(=O)C2(C1=O)O)O)/O)N

InChI

InChI=1S/C24H25N3O8/c1-2-6-26-16(30)10-27(25)23(34)19-15(29)9-13-8-12-7-11-4-3-5-14(28)17(11)20(31)18(12)21(32)24(13,35)22(19)33/h2-5,12-13,28,31,34-35H,1,6-10,25H2,(H,26,30)/b23-19+