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

Systemtic Name: N-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-N-cyclohexyl-2-phenyl-butanamide Openeye Name: N-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-N-cyclohexyl-2-phenyl-butanamide CAS Name: N-[[1-[(3-chlorophenyl)methyl]-2-pyrrolyl]methyl]-N-cyclohexyl-2-phenylbutanamide IUPAC Name: N-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-N-cyclohexyl-2-phenylbutanamide Traditional Name: N-[[1-(3-chlorobenzyl)pyrrol-2-yl]methyl]-N-cyclohexyl-2-phenyl-butyramide Formula: C28H33ClN2O MolecularWeight: 449.02742

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H33ClN2O/c1-2-27(23-12-5-3-6-13-23)28(32)31(25-15-7-4-8-16-25)21-26-17-10-18-30(26)20-22-11-9-14-24(29)19-22/h3,5-6,9-14,17-19,25,27H,2,4,7-8,15-16,20-21H2,1H3