N-[(3-chloranyl-2-pyrrol-1-yl-phenyl)methyl]cyclohexanecarboxamide

Systemtic Name: N-[(3-chloranyl-2-pyrrol-1-yl-phenyl)methyl]cyclohexanecarboxamide Openeye Name: N-[(3-chloro-2-pyrrol-1-yl-phenyl)methyl]cyclohexanecarboxamide CAS Name: N-[[3-chloro-2-(1-pyrrolyl)phenyl]methyl]cyclohexanecarboxamide IUPAC Name: N-[(3-chloro-2-pyrrol-1-ylphenyl)methyl]cyclohexanecarboxamide Traditional Name: N-(3-chloro-2-pyrrol-1-yl-benzyl)cyclohexanecarboxamide Formula: C18H21ClN2O MolecularWeight: 316.82514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NCC2=C(C(=CC=C2)Cl)N3C=CC=C3

Isomeric SMILES

C1CCC(CC1)C(=O)NCC2=C(C(=CC=C2)Cl)N3C=CC=C3

InChI

InChI=1S/C18H21ClN2O/c19-16-10-6-9-15(17(16)21-11-4-5-12-21)13-20-18(22)14-7-2-1-3-8-14/h4-6,9-12,14H,1-3,7-8,13H2,(H,20,22)