[(3R)-3-[(3S)-3-methylpiperidin-1-yl]-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]methylazanium

Systemtic Name: [(3R)-3-[(3S)-3-methylpiperidin-1-yl]-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]methylazanium Openeye Name: [(3R)-1-benzyl-3-[(3S)-3-methyl-1-piperidyl]pyrrolidin-1-ium-3-yl]methylammonium CAS Name: [(3R)-3-[(3S)-3-methyl-1-piperidinyl]-1-(phenylmethyl)-3-pyrrolidin-1-iumyl]methylammonium IUPAC Name: [(3R)-1-benzyl-3-[(3S)-3-methylpiperidin-1-yl]pyrrolidin-1-ium-3-yl]methylazanium Traditional Name: [(3R)-1-benzyl-3-[(3S)-3-methylpiperidino]pyrrolidin-1-ium-3-yl]methylammonium Formula: C18H31N3+2 MolecularWeight: 289.45884

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2(CC[NH+](C2)CC3=CC=CC=C3)C[NH3+]

Isomeric SMILES

C[C@H]1CCCN(C1)[C@]2(CC[NH+](C2)CC3=CC=CC=C3)C[NH3+]

InChI

InChI=1S/C18H29N3/c1-16-6-5-10-21(12-16)18(14-19)9-11-20(15-18)13-17-7-3-2-4-8-17/h2-4,7-8,16H,5-6,9-15,19H2,1H3/p+2/t16-,18+/m0/s1