(3S)-1-(1-cyclopropylcarbonylpiperidin-4-yl)-N-methyl-N-phenethyl-piperidin-1-ium-3-carboxamide

Systemtic Name: (3S)-1-(1-cyclopropylcarbonylpiperidin-4-yl)-N-methyl-N-phenethyl-piperidin-1-ium-3-carboxamide Openeye Name: (3S)-1-[1-(cyclopropanecarbonyl)-4-piperidyl]-N-methyl-N-phenethyl-piperidin-1-ium-3-carboxamide CAS Name: (3S)-1-[1-[cyclopropyl(oxo)methyl]-4-piperidinyl]-N-methyl-N-phenethyl-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-1-[1-(cyclopropanecarbonyl)piperidin-4-yl]-N-methyl-N-phenethylpiperidin-1-ium-3-carboxamide Traditional Name: (3S)-1-[1-(cyclopropanecarbonyl)-4-piperidyl]-N-methyl-N-phenethyl-piperidin-1-ium-3-carboxamide Formula: C24H36N3O2+ MolecularWeight: 398.56154

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=C1)C(=O)C2CCC[NH+](C2)C3CCN(CC3)C(=O)C4CC4

Isomeric SMILES

CN(CCC1=CC=CC=C1)C(=O)[C@H]2CCC[NH+](C2)C3CCN(CC3)C(=O)C4CC4

InChI

InChI=1S/C24H35N3O2/c1-25(15-11-19-6-3-2-4-7-19)23(28)21-8-5-14-27(18-21)22-12-16-26(17-13-22)24(29)20-9-10-20/h2-4,6-7,20-22H,5,8-18H2,1H3/p+1/t21-/m0/s1