(2-azanyl-2-oxidanylidene-ethyl) 2,5-dimethyl-1-(phenylmethyl)pyrrole-3-carboxylate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 2,5-dimethyl-1-(phenylmethyl)pyrrole-3-carboxylate Openeye Name: (2-amino-2-oxo-ethyl) 1-benzyl-2,5-dimethyl-pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-1-(phenylmethyl)-3-pyrrolecarboxylic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 1-benzyl-2,5-dimethylpyrrole-3-carboxylate Traditional Name: 1-benzyl-2,5-dimethyl-pyrrole-3-carboxylic acid (2-amino-2-keto-ethyl) ester Formula: C16H18N2O3 MolecularWeight: 286.32572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2=CC=CC=C2)C)C(=O)OCC(=O)N

Isomeric SMILES

CC1=CC(=C(N1CC2=CC=CC=C2)C)C(=O)OCC(=O)N

InChI

InChI=1S/C16H18N2O3/c1-11-8-14(16(20)21-10-15(17)19)12(2)18(11)9-13-6-4-3-5-7-13/h3-8H,9-10H2,1-2H3,(H2,17,19)