N-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-N-cyclohexyl-4-ethyl-benzamide

Systemtic Name: N-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-N-cyclohexyl-4-ethyl-benzamide Openeye Name: N-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-N-cyclohexyl-4-ethyl-benzamide CAS Name: N-[[1-[(3-chlorophenyl)methyl]-2-pyrrolyl]methyl]-N-cyclohexyl-4-ethylbenzamide IUPAC Name: N-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-N-cyclohexyl-4-ethylbenzamide Traditional Name: N-[[1-(3-chlorobenzyl)pyrrol-2-yl]methyl]-N-cyclohexyl-4-ethyl-benzamide Formula: C27H31ClN2O MolecularWeight: 435.00084

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N(CC2=CC=CN2CC3=CC(=CC=C3)Cl)C4CCCCC4

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N(CC2=CC=CN2CC3=CC(=CC=C3)Cl)C4CCCCC4

InChI

InChI=1S/C27H31ClN2O/c1-2-21-13-15-23(16-14-21)27(31)30(25-10-4-3-5-11-25)20-26-12-7-17-29(26)19-22-8-6-9-24(28)18-22/h6-9,12-18,25H,2-5,10-11,19-20H2,1H3