2-[2-[4-[(3-methyl-1-oxidanylidene-4H-benzo[f]quinazolin-9-yl)methylamino]phenyl]-2-oxidanylidene-ethyl]pentanedioate

Systemtic Name: 2-[2-[4-[(3-methyl-1-oxidanylidene-4H-benzo[f]quinazolin-9-yl)methylamino]phenyl]-2-oxidanylidene-ethyl]pentanedioate Openeye Name: 2-[2-[4-[(3-methyl-1-oxo-4H-benzo[f]quinazolin-9-yl)methylamino]phenyl]-2-oxo-ethyl]pentanedioate CAS Name: 2-[2-[4-[(3-methyl-1-oxo-4H-benzo[f]quinazolin-9-yl)methylamino]phenyl]-2-oxoethyl]pentanedioate IUPAC Name: 2-[2-[4-[(3-methyl-1-oxo-4H-benzo[f]quinazolin-9-yl)methylamino]phenyl]-2-oxoethyl]pentanedioate Traditional Name: 2-[2-keto-2-[4-[(1-keto-3-methyl-4H-benzo[f]quinazolin-9-yl)methylamino]phenyl]ethyl]glutarate Formula: C27H23N3O6-2 MolecularWeight: 485.48802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)C2=C(N1)C=CC3=C2C=C(C=C3)CNC4=CC=C(C=C4)C(=O)CC(CCC(=O)[O-])C(=O)[O-]

Isomeric SMILES

CC1=NC(=O)C2=C(N1)C=CC3=C2C=C(C=C3)CNC4=CC=C(C=C4)C(=O)CC(CCC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C27H25N3O6/c1-15-29-22-10-6-17-3-2-16(12-21(17)25(22)26(34)30-15)14-28-20-8-4-18(5-9-20)23(31)13-19(27(35)36)7-11-24(32)33/h2-6,8-10,12,19,28H,7,11,13-14H2,1H3,(H,32,33)(H,35,36)(H,29,30,34)/p-2