(3S)-N-cyclopropyl-1-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-4-yl]piperidin-1-ium-3-carboxamide

Systemtic Name: (3S)-N-cyclopropyl-1-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-4-yl]piperidin-1-ium-3-carboxamide Openeye Name: (3S)-N-cyclopropyl-1-[1-[(1-methylpyrazol-4-yl)methyl]-4-piperidyl]piperidin-1-ium-3-carboxamide CAS Name: (3S)-N-cyclopropyl-1-[1-[(1-methyl-4-pyrazolyl)methyl]-4-piperidinyl]-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-N-cyclopropyl-1-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-4-yl]piperidin-1-ium-3-carboxamide Traditional Name: (3S)-N-cyclopropyl-1-[1-[(1-methylpyrazol-4-yl)methyl]-4-piperidyl]piperidin-1-ium-3-carboxamide Formula: C19H32N5O+ MolecularWeight: 346.49028

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CN2CCC(CC2)[NH+]3CCCC(C3)C(=O)NC4CC4

Isomeric SMILES

CN1C=C(C=N1)CN2CCC(CC2)[NH+]3CCC[C@@H](C3)C(=O)NC4CC4

InChI

InChI=1S/C19H31N5O/c1-22-12-15(11-20-22)13-23-9-6-18(7-10-23)24-8-2-3-16(14-24)19(25)21-17-4-5-17/h11-12,16-18H,2-10,13-14H2,1H3,(H,21,25)/p+1/t16-/m0/s1