(3S)-1-(cyclopropylmethyl)-N-(3,4-dimethylphenyl)piperidin-1-ium-3-amine

Systemtic Name: (3S)-1-(cyclopropylmethyl)-N-(3,4-dimethylphenyl)piperidin-1-ium-3-amine Openeye Name: (3S)-1-(cyclopropylmethyl)-N-(3,4-dimethylphenyl)piperidin-1-ium-3-amine CAS Name: (3S)-1-(cyclopropylmethyl)-N-(3,4-dimethylphenyl)-3-piperidin-1-iumamine IUPAC Name: (3S)-1-(cyclopropylmethyl)-N-(3,4-dimethylphenyl)piperidin-1-ium-3-amine Traditional Name: [(3S)-1-(cyclopropylmethyl)piperidin-1-ium-3-yl]-(3,4-dimethylphenyl)amine Formula: C17H27N2+ MolecularWeight: 259.40968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2CCC[NH+](C2)CC3CC3)C

Isomeric SMILES

CC1=C(C=C(C=C1)N[C@H]2CCC[NH+](C2)CC3CC3)C

InChI

InChI=1S/C17H26N2/c1-13-5-8-16(10-14(13)2)18-17-4-3-9-19(12-17)11-15-6-7-15/h5,8,10,15,17-18H,3-4,6-7,9,11-12H2,1-2H3/p+1/t17-/m0/s1