[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl] 1-ethyl-2,5-dimethyl-pyrrole-3-carboxylate

Systemtic Name: [2-oxidanylidene-2-[(phenylmethyl)amino]ethyl] 1-ethyl-2,5-dimethyl-pyrrole-3-carboxylate Openeye Name: [2-(benzylamino)-2-oxo-ethyl] 1-ethyl-2,5-dimethyl-pyrrole-3-carboxylate CAS Name: 1-ethyl-2,5-dimethyl-3-pyrrolecarboxylic acid [2-oxo-2-[(phenylmethyl)amino]ethyl] ester IUPAC Name: [2-(benzylamino)-2-oxoethyl] 1-ethyl-2,5-dimethylpyrrole-3-carboxylate Traditional Name: 1-ethyl-2,5-dimethyl-pyrrole-3-carboxylic acid [2-(benzylamino)-2-keto-ethyl] ester Formula: C18H22N2O3 MolecularWeight: 314.37888

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC(=C1C)C(=O)OCC(=O)NCC2=CC=CC=C2)C

Isomeric SMILES

CCN1C(=CC(=C1C)C(=O)OCC(=O)NCC2=CC=CC=C2)C

InChI

InChI=1S/C18H22N2O3/c1-4-20-13(2)10-16(14(20)3)18(22)23-12-17(21)19-11-15-8-6-5-7-9-15/h5-10H,4,11-12H2,1-3H3,(H,19,21)