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

Systemtic Name: 4-butyl-N-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl]-N-prop-2-enyl-benzamide Openeye Name: N-allyl-4-butyl-N-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl]benzamide CAS Name: 4-butyl-N-[[1-[(2-chlorophenyl)methyl]-2-pyrrolyl]methyl]-N-prop-2-enylbenzamide IUPAC Name: 4-butyl-N-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl]-N-prop-2-enylbenzamide Traditional Name: N-allyl-4-butyl-N-[[1-(2-chlorobenzyl)pyrrol-2-yl]methyl]benzamide Formula: C26H29ClN2O MolecularWeight: 420.97426

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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=C3Cl

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)N(CC=C)CC2=CC=CN2CC3=CC=CC=C3Cl

InChI

InChI=1S/C26H29ClN2O/c1-3-5-9-21-13-15-22(16-14-21)26(30)29(17-4-2)20-24-11-8-18-28(24)19-23-10-6-7-12-25(23)27/h4,6-8,10-16,18H,2-3,5,9,17,19-20H2,1H3