N-cyclohexyl-N-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]-4-pentyl-benzamide

Systemtic Name: N-cyclohexyl-N-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]-4-pentyl-benzamide Openeye Name: N-cyclohexyl-N-[[1-(m-tolylmethyl)pyrrol-2-yl]methyl]-4-pentyl-benzamide CAS Name: N-cyclohexyl-N-[[1-[(3-methylphenyl)methyl]-2-pyrrolyl]methyl]-4-pentylbenzamide IUPAC Name: N-cyclohexyl-N-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]-4-pentylbenzamide Traditional Name: 4-amyl-N-cyclohexyl-N-[[1-(3-methylbenzyl)pyrrol-2-yl]methyl]benzamide Formula: C31H40N2O MolecularWeight: 456.6621

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)N(CC2=CC=CN2CC3=CC=CC(=C3)C)C4CCCCC4

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)N(CC2=CC=CN2CC3=CC=CC(=C3)C)C4CCCCC4

InChI

InChI=1S/C31H40N2O/c1-3-4-6-12-26-17-19-28(20-18-26)31(34)33(29-14-7-5-8-15-29)24-30-16-10-21-32(30)23-27-13-9-11-25(2)22-27/h9-11,13,16-22,29H,3-8,12,14-15,23-24H2,1-2H3