methyl 4-[[[2,5-dimethyl-1-(phenylmethyl)pyrrol-3-yl]carbonylamino]methyl]benzoate

Systemtic Name: methyl 4-[[[2,5-dimethyl-1-(phenylmethyl)pyrrol-3-yl]carbonylamino]methyl]benzoate Openeye Name: methyl 4-[[(1-benzyl-2,5-dimethyl-pyrrole-3-carbonyl)amino]methyl]benzoate CAS Name: 4-[[[[2,5-dimethyl-1-(phenylmethyl)-3-pyrrolyl]-oxomethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(1-benzyl-2,5-dimethylpyrrole-3-carbonyl)amino]methyl]benzoate Traditional Name: 4-[[(1-benzyl-2,5-dimethyl-pyrrole-3-carbonyl)amino]methyl]benzoic acid methyl ester Formula: C23H24N2O3 MolecularWeight: 376.44826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2=CC=CC=C2)C)C(=O)NCC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=CC(=C(N1CC2=CC=CC=C2)C)C(=O)NCC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C23H24N2O3/c1-16-13-21(17(2)25(16)15-19-7-5-4-6-8-19)22(26)24-14-18-9-11-20(12-10-18)23(27)28-3/h4-13H,14-15H2,1-3H3,(H,24,26)