(phenylmethyl) 1,2,3,5-tetrahydro-1,4-benzodiazepine-4-carboxylate

Systemtic Name: (phenylmethyl) 1,2,3,5-tetrahydro-1,4-benzodiazepine-4-carboxylate Openeye Name: benzyl 1,2,3,5-tetrahydro-1,4-benzodiazepine-4-carboxylate CAS Name: 1,2,3,5-tetrahydro-1,4-benzodiazepine-4-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 1,2,3,5-tetrahydro-1,4-benzodiazepine-4-carboxylate Traditional Name: 1,2,3,5-tetrahydro-1,4-benzodiazepine-4-carboxylic acid benzyl ester Formula: C17H18N2O2 MolecularWeight: 282.33702

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C2N1)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1CN(CC2=CC=CC=C2N1)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C17H18N2O2/c20-17(21-13-14-6-2-1-3-7-14)19-11-10-18-16-9-5-4-8-15(16)12-19/h1-9,18H,10-13H2