3-[2-[(4S)-4-methyl-2-oxidanylidene-3,4-dihydro-1H-1,5-benzodiazepin-5-yl]-2-oxidanylidene-ethoxy]benzoate

Systemtic Name: 3-[2-[(4S)-4-methyl-2-oxidanylidene-3,4-dihydro-1H-1,5-benzodiazepin-5-yl]-2-oxidanylidene-ethoxy]benzoate Openeye Name: 3-[2-[(4S)-4-methyl-2-oxo-3,4-dihydro-1H-1,5-benzodiazepin-5-yl]-2-oxo-ethoxy]benzoate CAS Name: 3-[2-[(4S)-4-methyl-2-oxo-3,4-dihydro-1H-1,5-benzodiazepin-5-yl]-2-oxoethoxy]benzoate IUPAC Name: 3-[2-[(4S)-4-methyl-2-oxo-3,4-dihydro-1H-1,5-benzodiazepin-5-yl]-2-oxoethoxy]benzoate Traditional Name: 3-[2-keto-2-[(4S)-2-keto-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-5-yl]ethoxy]benzoate Formula: C19H17N2O5- MolecularWeight: 353.34868

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NC2=CC=CC=C2N1C(=O)COC3=CC=CC(=C3)C(=O)[O-]

Isomeric SMILES

C[C@H]1CC(=O)NC2=CC=CC=C2N1C(=O)COC3=CC=CC(=C3)C(=O)[O-]

InChI

InChI=1S/C19H18N2O5/c1-12-9-17(22)20-15-7-2-3-8-16(15)21(12)18(23)11-26-14-6-4-5-13(10-14)19(24)25/h2-8,10,12H,9,11H2,1H3,(H,20,22)(H,24,25)/p-1/t12-/m0/s1