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

Systemtic Name: (phenylmethyl) 3,5-dimethyl-4-[3-[[(1R)-1-naphthalen-1-ylethyl]amino]-3-oxidanylidene-propyl]-1H-pyrrole-2-carboxylate Openeye Name: benzyl 3,5-dimethyl-4-[3-[[(1R)-1-(1-naphthyl)ethyl]amino]-3-oxo-propyl]-1H-pyrrole-2-carboxylate CAS Name: 3,5-dimethyl-4-[3-[[(1R)-1-(1-naphthalenyl)ethyl]amino]-3-oxopropyl]-1H-pyrrole-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3,5-dimethyl-4-[3-[[(1R)-1-naphthalen-1-ylethyl]amino]-3-oxopropyl]-1H-pyrrole-2-carboxylate Traditional Name: 4-[3-keto-3-[[(1R)-1-(1-naphthyl)ethyl]amino]propyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid benzyl ester Formula: C29H30N2O3 MolecularWeight: 454.5601

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1CCC(=O)NC(C)C2=CC=CC3=CC=CC=C32)C)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC1=C(NC(=C1CCC(=O)N[C@H](C)C2=CC=CC3=CC=CC=C32)C)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C29H30N2O3/c1-19-24(20(2)31-28(19)29(33)34-18-22-10-5-4-6-11-22)16-17-27(32)30-21(3)25-15-9-13-23-12-7-8-14-26(23)25/h4-15,21,31H,16-18H2,1-3H3,(H,30,32)/t21-/m1/s1