phenyl-[(3S)-1-[(3R)-1-phenylpyrrolidin-3-yl]piperidin-1-ium-3-yl]methanone

Systemtic Name: phenyl-[(3S)-1-[(3R)-1-phenylpyrrolidin-3-yl]piperidin-1-ium-3-yl]methanone Openeye Name: phenyl-[(3S)-1-[(3R)-1-phenylpyrrolidin-3-yl]piperidin-1-ium-3-yl]methanone CAS Name: phenyl-[(3S)-1-[(3R)-1-phenyl-3-pyrrolidinyl]-3-piperidin-1-iumyl]methanone IUPAC Name: phenyl-[(3S)-1-[(3R)-1-phenylpyrrolidin-3-yl]piperidin-1-ium-3-yl]methanone Traditional Name: phenyl-[(3S)-1-[(3R)-1-phenylpyrrolidin-3-yl]piperidin-1-ium-3-yl]methanone Formula: C22H27N2O+ MolecularWeight: 335.46258

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)C2CCN(C2)C3=CC=CC=C3)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1C[C@@H](C[NH+](C1)[C@@H]2CCN(C2)C3=CC=CC=C3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H26N2O/c25-22(18-8-3-1-4-9-18)19-10-7-14-23(16-19)21-13-15-24(17-21)20-11-5-2-6-12-20/h1-6,8-9,11-12,19,21H,7,10,13-17H2/p+1/t19-,21+/m0/s1