[(3S)-1-[(3-chloranyl-4-methoxy-phenyl)carbamoyl]piperidin-3-yl]-methyl-(2-pyridin-2-ylethyl)azanium

Systemtic Name: [(3S)-1-[(3-chloranyl-4-methoxy-phenyl)carbamoyl]piperidin-3-yl]-methyl-(2-pyridin-2-ylethyl)azanium Openeye Name: [(3S)-1-[(3-chloro-4-methoxy-phenyl)carbamoyl]-3-piperidyl]-methyl-[2-(2-pyridyl)ethyl]ammonium CAS Name: [(3S)-1-[(3-chloro-4-methoxyanilino)-oxomethyl]-3-piperidinyl]-methyl-[2-(2-pyridinyl)ethyl]ammonium IUPAC Name: [(3S)-1-[(3-chloro-4-methoxyphenyl)carbamoyl]piperidin-3-yl]-methyl-(2-pyridin-2-ylethyl)azanium Traditional Name: [(3S)-1-[(3-chloro-4-methoxy-phenyl)carbamoyl]-3-piperidyl]-methyl-[2-(2-pyridyl)ethyl]ammonium Formula: C21H28ClN4O2+ MolecularWeight: 403.92562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC1=CC=CC=N1)C2CCCN(C2)C(=O)NC3=CC(=C(C=C3)OC)Cl

Isomeric SMILES

C[NH+](CCC1=CC=CC=N1)[C@H]2CCCN(C2)C(=O)NC3=CC(=C(C=C3)OC)Cl

InChI

InChI=1S/C21H27ClN4O2/c1-25(13-10-16-6-3-4-11-23-16)18-7-5-12-26(15-18)21(27)24-17-8-9-20(28-2)19(22)14-17/h3-4,6,8-9,11,14,18H,5,7,10,12-13,15H2,1-2H3,(H,24,27)/p+1/t18-/m0/s1