(3S)-N-(3,4-dimethylphenyl)-1-(phenylmethyl)pyrrolidin-1-ium-3-amine

Systemtic Name: (3S)-N-(3,4-dimethylphenyl)-1-(phenylmethyl)pyrrolidin-1-ium-3-amine Openeye Name: (3S)-1-benzyl-N-(3,4-dimethylphenyl)pyrrolidin-1-ium-3-amine CAS Name: (3S)-N-(3,4-dimethylphenyl)-1-(phenylmethyl)-3-pyrrolidin-1-iumamine IUPAC Name: (3S)-1-benzyl-N-(3,4-dimethylphenyl)pyrrolidin-1-ium-3-amine Traditional Name: [(3S)-1-benzylpyrrolidin-1-ium-3-yl]-(3,4-dimethylphenyl)amine Formula: C19H25N2+ MolecularWeight: 281.4152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2CC[NH+](C2)CC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)N[C@H]2CC[NH+](C2)CC3=CC=CC=C3)C

InChI

InChI=1S/C19H24N2/c1-15-8-9-18(12-16(15)2)20-19-10-11-21(14-19)13-17-6-4-3-5-7-17/h3-9,12,19-20H,10-11,13-14H2,1-2H3/p+1/t19-/m0/s1