N-(4-azanyl-5-chloranyl-2-methoxy-phenyl)-1-(cycloheptylmethyl)piperidine-4-carboxamide

Systemtic Name: N-(4-azanyl-5-chloranyl-2-methoxy-phenyl)-1-(cycloheptylmethyl)piperidine-4-carboxamide Openeye Name: N-(4-amino-5-chloro-2-methoxy-phenyl)-1-(cycloheptylmethyl)piperidine-4-carboxamide CAS Name: N-(4-amino-5-chloro-2-methoxyphenyl)-1-(cycloheptylmethyl)-4-piperidinecarboxamide IUPAC Name: N-(4-amino-5-chloro-2-methoxyphenyl)-1-(cycloheptylmethyl)piperidine-4-carboxamide Traditional Name: N-(4-amino-5-chloro-2-methoxy-phenyl)-1-(cycloheptylmethyl)isonipecotamide Formula: C21H32ClN3O2 MolecularWeight: 393.95068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)N)Cl)NC(=O)C2CCN(CC2)CC3CCCCCC3

Isomeric SMILES

COC1=C(C=C(C(=C1)N)Cl)NC(=O)C2CCN(CC2)CC3CCCCCC3

InChI

InChI=1S/C21H32ClN3O2/c1-27-20-13-18(23)17(22)12-19(20)24-21(26)16-8-10-25(11-9-16)14-15-6-4-2-3-5-7-15/h12-13,15-16H,2-11,14,23H2,1H3,(H,24,26)