(phenylmethyl) 4-(3-methoxy-3-oxidanylidene-propyl)-3-methyl-5-(1H-pyrrol-2-ylmethyl)-1H-pyrrole-2-carboxylate

Systemtic Name: (phenylmethyl) 4-(3-methoxy-3-oxidanylidene-propyl)-3-methyl-5-(1H-pyrrol-2-ylmethyl)-1H-pyrrole-2-carboxylate Openeye Name: benzyl 4-(3-methoxy-3-oxo-propyl)-3-methyl-5-(1H-pyrrol-2-ylmethyl)-1H-pyrrole-2-carboxylate CAS Name: 4-(3-methoxy-3-oxopropyl)-3-methyl-5-(1H-pyrrol-2-ylmethyl)-1H-pyrrole-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-(3-methoxy-3-oxopropyl)-3-methyl-5-(1H-pyrrol-2-ylmethyl)-1H-pyrrole-2-carboxylate Traditional Name: 4-(3-keto-3-methoxy-propyl)-3-methyl-5-(1H-pyrrol-2-ylmethyl)-1H-pyrrole-2-carboxylic acid benzyl ester Formula: C22H24N2O4 MolecularWeight: 380.43696

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1CCC(=O)OC)CC2=CC=CN2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=C(NC(=C1CCC(=O)OC)CC2=CC=CN2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H24N2O4/c1-15-18(10-11-20(25)27-2)19(13-17-9-6-12-23-17)24-21(15)22(26)28-14-16-7-4-3-5-8-16/h3-9,12,23-24H,10-11,13-14H2,1-2H3