(phenylmethyl) 5-[(4-ethanoyl-5-methyl-1H-pyrrol-2-yl)methyl]-4-(3-ethoxy-3-oxidanylidene-propyl)-3-methyl-1H-pyrrole-2-carboxylate

Systemtic Name: (phenylmethyl) 5-[(4-ethanoyl-5-methyl-1H-pyrrol-2-yl)methyl]-4-(3-ethoxy-3-oxidanylidene-propyl)-3-methyl-1H-pyrrole-2-carboxylate Openeye Name: benzyl 5-[(4-acetyl-5-methyl-1H-pyrrol-2-yl)methyl]-4-(3-ethoxy-3-oxo-propyl)-3-methyl-1H-pyrrole-2-carboxylate CAS Name: 5-[(4-acetyl-5-methyl-1H-pyrrol-2-yl)methyl]-4-(3-ethoxy-3-oxopropyl)-3-methyl-1H-pyrrole-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 5-[(4-acetyl-5-methyl-1H-pyrrol-2-yl)methyl]-4-(3-ethoxy-3-oxopropyl)-3-methyl-1H-pyrrole-2-carboxylate Traditional Name: 5-[(4-acetyl-5-methyl-1H-pyrrol-2-yl)methyl]-4-(3-ethoxy-3-keto-propyl)-3-methyl-1H-pyrrole-2-carboxylic acid benzyl ester Formula: C26H30N2O5 MolecularWeight: 450.5268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=C(NC(=C1C)C(=O)OCC2=CC=CC=C2)CC3=CC(=C(N3)C)C(=O)C

Isomeric SMILES

CCOC(=O)CCC1=C(NC(=C1C)C(=O)OCC2=CC=CC=C2)CC3=CC(=C(N3)C)C(=O)C

InChI

InChI=1S/C26H30N2O5/c1-5-32-24(30)12-11-21-16(2)25(26(31)33-15-19-9-7-6-8-10-19)28-23(21)14-20-13-22(18(4)29)17(3)27-20/h6-10,13,27-28H,5,11-12,14-15H2,1-4H3