N-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-N-pentyl-2-phenyl-butanamide

Systemtic Name: N-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-N-pentyl-2-phenyl-butanamide Openeye Name: N-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-N-pentyl-2-phenyl-butanamide CAS Name: N-[[1-[(3-chlorophenyl)methyl]-2-pyrrolyl]methyl]-N-pentyl-2-phenylbutanamide IUPAC Name: N-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-N-pentyl-2-phenylbutanamide Traditional Name: N-amyl-N-[[1-(3-chlorobenzyl)pyrrol-2-yl]methyl]-2-phenyl-butyramide Formula: C27H33ClN2O MolecularWeight: 437.01672

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC1=CC=CN1CC2=CC(=CC=C2)Cl)C(=O)C(CC)C3=CC=CC=C3

Isomeric SMILES

CCCCCN(CC1=CC=CN1CC2=CC(=CC=C2)Cl)C(=O)C(CC)C3=CC=CC=C3

InChI

InChI=1S/C27H33ClN2O/c1-3-5-9-17-30(27(31)26(4-2)23-13-7-6-8-14-23)21-25-16-11-18-29(25)20-22-12-10-15-24(28)19-22/h6-8,10-16,18-19,26H,3-5,9,17,20-21H2,1-2H3