(2S)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]-N-(4-piperidin-1-ylphenyl)propanamide

Systemtic Name: (2S)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]-N-(4-piperidin-1-ylphenyl)propanamide Openeye Name: (2S)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]-N-[4-(1-piperidyl)phenyl]propanamide CAS Name: (2S)-2-[(3S)-3-methyl-1-piperidin-1-iumyl]-N-[4-(1-piperidinyl)phenyl]propanamide IUPAC Name: (2S)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]-N-(4-piperidin-1-ylphenyl)propanamide Traditional Name: (2S)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]-N-(4-piperidinophenyl)propionamide Formula: C20H32N3O+ MolecularWeight: 330.48758

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)C(C)C(=O)NC2=CC=C(C=C2)N3CCCCC3

Isomeric SMILES

C[C@H]1CCC[NH+](C1)[C@@H](C)C(=O)NC2=CC=C(C=C2)N3CCCCC3

InChI

InChI=1S/C20H31N3O/c1-16-7-6-14-23(15-16)17(2)20(24)21-18-8-10-19(11-9-18)22-12-4-3-5-13-22/h8-11,16-17H,3-7,12-15H2,1-2H3,(H,21,24)/p+1/t16-,17-/m0/s1