N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-3-(4-dimethylaminophenyl)propanamide

Systemtic Name: N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-3-(4-dimethylaminophenyl)propanamide Openeye Name: N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-3-(4-dimethylaminophenyl)propanamide CAS Name: N-[(3S)-1-cycloheptyl-3-piperidin-1-iumyl]-3-(4-dimethylaminophenyl)propanamide IUPAC Name: N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-3-(4-dimethylaminophenyl)propanamide Traditional Name: N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-3-(4-dimethylaminophenyl)propionamide Formula: C23H38N3O+ MolecularWeight: 372.56732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CCC(=O)NC2CCC[NH+](C2)C3CCCCCC3

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CCC(=O)N[C@H]2CCC[NH+](C2)C3CCCCCC3

InChI

InChI=1S/C23H37N3O/c1-25(2)21-14-11-19(12-15-21)13-16-23(27)24-20-8-7-17-26(18-20)22-9-5-3-4-6-10-22/h11-12,14-15,20,22H,3-10,13,16-18H2,1-2H3,(H,24,27)/p+1/t20-/m0/s1