(2Z)-2-[azanyl(oxidanyl)methylidene]-4-(dimethylamino)-7-[2-(3-hydroxyphenyl)ethynyl]-10,11,12a-tris(oxidanyl)-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,12-trione

Systemtic Name: (2Z)-2-[azanyl(oxidanyl)methylidene]-4-(dimethylamino)-7-[2-(3-hydroxyphenyl)ethynyl]-10,11,12a-tris(oxidanyl)-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,12-trione Openeye Name: (2Z)-2-[amino(hydroxy)methylene]-4-(dimethylamino)-10,11,12a-trihydroxy-7-[2-(3-hydroxyphenyl)ethynyl]-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,12-trione CAS Name: (2Z)-2-[amino(hydroxy)methylidene]-4-(dimethylamino)-10,11,12a-trihydroxy-7-[2-(3-hydroxyphenyl)ethynyl]-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,12-trione IUPAC Name: (2Z)-2-[amino(hydroxy)methylidene]-4-(dimethylamino)-10,11,12a-trihydroxy-7-[2-(3-hydroxyphenyl)ethynyl]-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,12-trione Traditional Name: (2Z)-2-[amino(hydroxy)methylene]-4-(dimethylamino)-10,11,12a-trihydroxy-7-[2-(3-hydroxyphenyl)ethynyl]-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,12-trione Formula: C29H26N2O8 MolecularWeight: 530.52534

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1C2CC3CC4=C(C=CC(=C4C(=C3C(=O)C2(C(=O)C(=C(N)O)C1=O)O)O)O)C#CC5=CC(=CC=C5)O

Isomeric SMILES

CN(C)C1C2CC3CC4=C(C=CC(=C4C(=C3C(=O)C2(C(=O)/C(=C(/N)\O)/C1=O)O)O)O)C#CC5=CC(=CC=C5)O

InChI

InChI=1S/C29H26N2O8/c1-31(2)23-18-12-15-11-17-14(7-6-13-4-3-5-16(32)10-13)8-9-19(33)21(17)24(34)20(15)26(36)29(18,39)27(37)22(25(23)35)28(30)38/h3-5,8-10,15,18,23,32-34,38-39H,11-12,30H2,1-2H3/b28-22-