4-butyl-N-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]-N-prop-2-enyl-benzamide

Systemtic Name: 4-butyl-N-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]-N-prop-2-enyl-benzamide Openeye Name: N-allyl-4-butyl-N-[[1-(m-tolylmethyl)pyrrol-2-yl]methyl]benzamide CAS Name: 4-butyl-N-[[1-[(3-methylphenyl)methyl]-2-pyrrolyl]methyl]-N-prop-2-enylbenzamide IUPAC Name: 4-butyl-N-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]-N-prop-2-enylbenzamide Traditional Name: N-allyl-4-butyl-N-[[1-(3-methylbenzyl)pyrrol-2-yl]methyl]benzamide Formula: C27H32N2O MolecularWeight: 400.55578

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)N(CC=C)CC2=CC=CN2CC3=CC=CC(=C3)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)N(CC=C)CC2=CC=CN2CC3=CC=CC(=C3)C

InChI

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