aminocarbonyl 2-(1-methyl-3-oxidanylidene-4-phenethyl-5-phenyl-2,5-dihydro-1,4-benzodiazepin-2-yl)ethanoate

Systemtic Name: aminocarbonyl 2-(1-methyl-3-oxidanylidene-4-phenethyl-5-phenyl-2,5-dihydro-1,4-benzodiazepin-2-yl)ethanoate Openeye Name: carbamoyl 2-(1-methyl-3-oxo-4-phenethyl-5-phenyl-2,5-dihydro-1,4-benzodiazepin-2-yl)acetate CAS Name: 2-(1-methyl-3-oxo-4-phenethyl-5-phenyl-2,5-dihydro-1,4-benzodiazepin-2-yl)acetic acid carbamoyl ester IUPAC Name: carbamoyl 2-(1-methyl-3-oxo-4-phenethyl-5-phenyl-2,5-dihydro-1,4-benzodiazepin-2-yl)acetate Traditional Name: 2-(3-keto-1-methyl-4-phenethyl-5-phenyl-2,5-dihydro-1,4-benzodiazepin-2-yl)acetic acid carbamoyl ester Formula: C27H27N3O4 MolecularWeight: 457.52098

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(C(=O)N(C(C2=CC=CC=C21)C3=CC=CC=C3)CCC4=CC=CC=C4)CC(=O)OC(=O)N

Isomeric SMILES

CN1C(C(=O)N(C(C2=CC=CC=C21)C3=CC=CC=C3)CCC4=CC=CC=C4)CC(=O)OC(=O)N

InChI

InChI=1S/C27H27N3O4/c1-29-22-15-9-8-14-21(22)25(20-12-6-3-7-13-20)30(17-16-19-10-4-2-5-11-19)26(32)23(29)18-24(31)34-27(28)33/h2-15,23,25H,16-18H2,1H3,(H2,28,33)