N-[(3S)-1-[1-[3-(3-methylphenyl)phenyl]piperidin-4-yl]pyrrolidin-1-ium-3-yl]ethanamide

Systemtic Name: N-[(3S)-1-[1-[3-(3-methylphenyl)phenyl]piperidin-4-yl]pyrrolidin-1-ium-3-yl]ethanamide Openeye Name: N-[(3S)-1-[1-[3-(m-tolyl)phenyl]-4-piperidyl]pyrrolidin-1-ium-3-yl]acetamide CAS Name: N-[(3S)-1-[1-[3-(3-methylphenyl)phenyl]-4-piperidinyl]-3-pyrrolidin-1-iumyl]acetamide IUPAC Name: N-[(3S)-1-[1-[3-(3-methylphenyl)phenyl]piperidin-4-yl]pyrrolidin-1-ium-3-yl]acetamide Traditional Name: N-[(3S)-1-[1-[3-(m-tolyl)phenyl]-4-piperidyl]pyrrolidin-1-ium-3-yl]acetamide Formula: C24H32N3O+ MolecularWeight: 378.53038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=CC(=CC=C2)N3CCC(CC3)[NH+]4CCC(C4)NC(=O)C

Isomeric SMILES

CC1=CC=CC(=C1)C2=CC(=CC=C2)N3CCC(CC3)[NH+]4CC[C@@H](C4)NC(=O)C

InChI

InChI=1S/C24H31N3O/c1-18-5-3-6-20(15-18)21-7-4-8-24(16-21)26-13-10-23(11-14-26)27-12-9-22(17-27)25-19(2)28/h3-8,15-16,22-23H,9-14,17H2,1-2H3,(H,25,28)/p+1/t22-/m0/s1