(E)-N-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]-N-pentyl-3-phenyl-prop-2-enamide

Systemtic Name: (E)-N-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]-N-pentyl-3-phenyl-prop-2-enamide Openeye Name: (E)-N-[[1-(m-tolylmethyl)pyrrol-2-yl]methyl]-N-pentyl-3-phenyl-prop-2-enamide CAS Name: (E)-N-[[1-[(3-methylphenyl)methyl]-2-pyrrolyl]methyl]-N-pentyl-3-phenyl-2-propenamide IUPAC Name: (E)-N-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]-N-pentyl-3-phenylprop-2-enamide Traditional Name: (E)-N-amyl-N-[[1-(3-methylbenzyl)pyrrol-2-yl]methyl]-3-phenyl-acrylamide Formula: C27H32N2O MolecularWeight: 400.55578

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC1=CC=CN1CC2=CC=CC(=C2)C)C(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CCCCCN(CC1=CC=CN1CC2=CC=CC(=C2)C)C(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C27H32N2O/c1-3-4-8-18-29(27(30)17-16-24-12-6-5-7-13-24)22-26-15-10-19-28(26)21-25-14-9-11-23(2)20-25/h5-7,9-17,19-20H,3-4,8,18,21-22H2,1-2H3/b17-16+