(3S)-N-[3-[methyl(phenyl)amino]propyl]piperidin-1-ium-3-carboxamide

Systemtic Name: (3S)-N-[3-[methyl(phenyl)amino]propyl]piperidin-1-ium-3-carboxamide Openeye Name: (3S)-N-[3-(N-methylanilino)propyl]piperidin-1-ium-3-carboxamide CAS Name: (3S)-N-[3-(N-methylanilino)propyl]-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-N-[3-(N-methylanilino)propyl]piperidin-1-ium-3-carboxamide Traditional Name: (3S)-N-[3-(N-methylanilino)propyl]piperidin-1-ium-3-carboxamide Formula: C16H26N3O+ MolecularWeight: 276.39714

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCNC(=O)C1CCC[NH2+]C1)C2=CC=CC=C2

Isomeric SMILES

CN(CCCNC(=O)[C@H]1CCC[NH2+]C1)C2=CC=CC=C2

InChI

InChI=1S/C16H25N3O/c1-19(15-8-3-2-4-9-15)12-6-11-18-16(20)14-7-5-10-17-13-14/h2-4,8-9,14,17H,5-7,10-13H2,1H3,(H,18,20)/p+1/t14-/m0/s1