N,4-dibutyl-N-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]benzamide

Systemtic Name: N,4-dibutyl-N-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]benzamide Openeye Name: N,4-dibutyl-N-[[1-(m-tolylmethyl)pyrrol-2-yl]methyl]benzamide CAS Name: N,4-dibutyl-N-[[1-[(3-methylphenyl)methyl]-2-pyrrolyl]methyl]benzamide IUPAC Name: N,4-dibutyl-N-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]benzamide Traditional Name: N,4-dibutyl-N-[[1-(3-methylbenzyl)pyrrol-2-yl]methyl]benzamide Formula: C28H36N2O MolecularWeight: 416.59824

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H36N2O/c1-4-6-11-24-14-16-26(17-15-24)28(31)30(18-7-5-2)22-27-13-9-19-29(27)21-25-12-8-10-23(3)20-25/h8-10,12-17,19-20H,4-7,11,18,21-22H2,1-3H3