2-[1-azanyl-7-[(3-methyl-1-oxidanylidene-4H-benzo[f]quinazolin-9-yl)methyl]-3-oxidanylidene-1H-isoindol-2-yl]pentanedioic acid

Systemtic Name: 2-[1-azanyl-7-[(3-methyl-1-oxidanylidene-4H-benzo[f]quinazolin-9-yl)methyl]-3-oxidanylidene-1H-isoindol-2-yl]pentanedioic acid Openeye Name: 2-[3-amino-4-[(3-methyl-1-oxo-4H-benzo[f]quinazolin-9-yl)methyl]-1-oxo-isoindolin-2-yl]pentanedioic acid CAS Name: 2-[1-amino-7-[(3-methyl-1-oxo-4H-benzo[f]quinazolin-9-yl)methyl]-3-oxo-1H-isoindol-2-yl]pentanedioic acid IUPAC Name: 2-[1-amino-7-[(3-methyl-1-oxo-4H-benzo[f]quinazolin-9-yl)methyl]-3-oxo-1H-isoindol-2-yl]pentanedioic acid Traditional Name: 2-[3-amino-1-keto-4-[(1-keto-3-methyl-4H-benzo[f]quinazolin-9-yl)methyl]isoindolin-2-yl]glutaric acid Formula: C27H24N4O6 MolecularWeight: 500.50266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)C2=C(N1)C=CC3=C2C=C(C=C3)CC4=CC=CC5=C4C(N(C5=O)C(CCC(=O)O)C(=O)O)N

Isomeric SMILES

CC1=NC(=O)C2=C(N1)C=CC3=C2C=C(C=C3)CC4=CC=CC5=C4C(N(C5=O)C(CCC(=O)O)C(=O)O)N

InChI

InChI=1S/C27H24N4O6/c1-13-29-19-8-7-15-6-5-14(12-18(15)23(19)25(34)30-13)11-16-3-2-4-17-22(16)24(28)31(26(17)35)20(27(36)37)9-10-21(32)33/h2-8,12,20,24H,9-11,28H2,1H3,(H,32,33)(H,36,37)(H,29,30,34)