methyl 3-methyl-4-[[2-[(4R)-4-methyl-2-oxidanylidene-3,4-dihydro-1H-1,5-benzodiazepin-5-yl]-2-oxidanylidene-ethyl]amino]benzoate

Systemtic Name: methyl 3-methyl-4-[[2-[(4R)-4-methyl-2-oxidanylidene-3,4-dihydro-1H-1,5-benzodiazepin-5-yl]-2-oxidanylidene-ethyl]amino]benzoate Openeye Name: methyl 3-methyl-4-[[2-[(4R)-4-methyl-2-oxo-3,4-dihydro-1H-1,5-benzodiazepin-5-yl]-2-oxo-ethyl]amino]benzoate CAS Name: 3-methyl-4-[[2-[(4R)-4-methyl-2-oxo-3,4-dihydro-1H-1,5-benzodiazepin-5-yl]-2-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-methyl-4-[[2-[(4R)-4-methyl-2-oxo-3,4-dihydro-1H-1,5-benzodiazepin-5-yl]-2-oxoethyl]amino]benzoate Traditional Name: 4-[[2-keto-2-[(4R)-2-keto-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-5-yl]ethyl]amino]-3-methyl-benzoic acid methyl ester Formula: C21H23N3O4 MolecularWeight: 381.42502

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NC2=CC=CC=C2N1C(=O)CNC3=C(C=C(C=C3)C(=O)OC)C

Isomeric SMILES

C[C@@H]1CC(=O)NC2=CC=CC=C2N1C(=O)CNC3=C(C=C(C=C3)C(=O)OC)C

InChI

InChI=1S/C21H23N3O4/c1-13-10-15(21(27)28-3)8-9-16(13)22-12-20(26)24-14(2)11-19(25)23-17-6-4-5-7-18(17)24/h4-10,14,22H,11-12H2,1-3H3,(H,23,25)/t14-/m1/s1