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

Systemtic Name: 4-hexyl-N-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]-N-prop-2-enyl-benzamide Openeye Name: N-allyl-4-hexyl-N-[[1-(m-tolylmethyl)pyrrol-2-yl]methyl]benzamide CAS Name: 4-hexyl-N-[[1-[(3-methylphenyl)methyl]-2-pyrrolyl]methyl]-N-prop-2-enylbenzamide IUPAC Name: 4-hexyl-N-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]-N-prop-2-enylbenzamide Traditional Name: N-allyl-4-hexyl-N-[[1-(3-methylbenzyl)pyrrol-2-yl]methyl]benzamide Formula: C29H36N2O MolecularWeight: 428.60894

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C(=O)N(CC=C)CC2=CC=CN2CC3=CC=CC(=C3)C

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C(=O)N(CC=C)CC2=CC=CN2CC3=CC=CC(=C3)C

InChI

InChI=1S/C29H36N2O/c1-4-6-7-8-12-25-15-17-27(18-16-25)29(32)31(19-5-2)23-28-14-10-20-30(28)22-26-13-9-11-24(3)21-26/h5,9-11,13-18,20-21H,2,4,6-8,12,19,22-23H2,1,3H3