O4-(7-chloranyl-2-oxidanylidene-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl) O1-[(7-methoxy-2-oxidanylidene-chromen-4-yl)methyl] butanedioate

Systemtic Name: O4-(7-chloranyl-2-oxidanylidene-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl) O1-[(7-methoxy-2-oxidanylidene-chromen-4-yl)methyl] butanedioate Openeye Name: O4-(7-chloro-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl) O1-[(7-methoxy-2-oxo-chromen-4-yl)methyl] butanedioate CAS Name: butanedioic acid O4-(7-chloro-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl) ester O1-[(7-methoxy-2-oxo-1-benzopyran-4-yl)methyl] ester IUPAC Name: 4-O-(7-chloro-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl) 1-O-[(7-methoxy-2-oxochromen-4-yl)methyl] butanedioate Traditional Name: succinic acid O4-(7-chloro-2-keto-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl) ester O1-[(2-keto-7-methoxy-chromen-4-yl)methyl] ester Formula: C30H23ClN2O8 MolecularWeight: 574.96522

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CCC(=O)OC3C(=O)NC4=C(C=C(C=C4)Cl)C(=N3)C5=CC=CC=C5

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CCC(=O)OC3C(=O)NC4=C(C=C(C=C4)Cl)C(=N3)C5=CC=CC=C5

InChI

InChI=1S/C30H23ClN2O8/c1-38-20-8-9-21-18(13-27(36)40-24(21)15-20)16-39-25(34)11-12-26(35)41-30-29(37)32-23-10-7-19(31)14-22(23)28(33-30)17-5-3-2-4-6-17/h2-10,13-15,30H,11-12,16H2,1H3,(H,32,37)