(phenylmethyl) 3,5-dimethyl-4-[2-[[(1S)-1-naphthalen-1-ylethyl]amino]-2-oxidanylidene-ethyl]-1H-pyrrole-2-carboxylate

Systemtic Name: (phenylmethyl) 3,5-dimethyl-4-[2-[[(1S)-1-naphthalen-1-ylethyl]amino]-2-oxidanylidene-ethyl]-1H-pyrrole-2-carboxylate Openeye Name: benzyl 3,5-dimethyl-4-[2-[[(1S)-1-(1-naphthyl)ethyl]amino]-2-oxo-ethyl]-1H-pyrrole-2-carboxylate CAS Name: 3,5-dimethyl-4-[2-[[(1S)-1-(1-naphthalenyl)ethyl]amino]-2-oxoethyl]-1H-pyrrole-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3,5-dimethyl-4-[2-[[(1S)-1-naphthalen-1-ylethyl]amino]-2-oxoethyl]-1H-pyrrole-2-carboxylate Traditional Name: 4-[2-keto-2-[[(1S)-1-(1-naphthyl)ethyl]amino]ethyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid benzyl ester Formula: C28H28N2O3 MolecularWeight: 440.53352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1CC(=O)NC(C)C2=CC=CC3=CC=CC=C32)C)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC1=C(NC(=C1CC(=O)N[C@@H](C)C2=CC=CC3=CC=CC=C32)C)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C28H28N2O3/c1-18-25(20(3)30-27(18)28(32)33-17-21-10-5-4-6-11-21)16-26(31)29-19(2)23-15-9-13-22-12-7-8-14-24(22)23/h4-15,19,30H,16-17H2,1-3H3,(H,29,31)/t19-/m0/s1