methyl 5-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]-1-(phenylmethyl)-4-propan-2-yl-pyrrole-3-carboxylate

Systemtic Name: methyl 5-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]-1-(phenylmethyl)-4-propan-2-yl-pyrrole-3-carboxylate Openeye Name: methyl 1-benzyl-5-[2-(benzylamino)-2-oxo-ethyl]-4-isopropyl-pyrrole-3-carboxylate CAS Name: 5-[2-oxo-2-[(phenylmethyl)amino]ethyl]-1-(phenylmethyl)-4-propan-2-yl-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 1-benzyl-5-[2-(benzylamino)-2-oxoethyl]-4-propan-2-ylpyrrole-3-carboxylate Traditional Name: 1-benzyl-5-[2-(benzylamino)-2-keto-ethyl]-4-isopropyl-pyrrole-3-carboxylic acid methyl ester Formula: C25H28N2O3 MolecularWeight: 404.50142

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(N(C=C1C(=O)OC)CC2=CC=CC=C2)CC(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC(C)C1=C(N(C=C1C(=O)OC)CC2=CC=CC=C2)CC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C25H28N2O3/c1-18(2)24-21(25(29)30-3)17-27(16-20-12-8-5-9-13-20)22(24)14-23(28)26-15-19-10-6-4-7-11-19/h4-13,17-18H,14-16H2,1-3H3,(H,26,28)