(3S)-N-cyclopropyl-1-[1-(quinolin-2-ylmethyl)piperidin-1-ium-4-yl]piperidin-1-ium-3-carboxamide

Systemtic Name: (3S)-N-cyclopropyl-1-[1-(quinolin-2-ylmethyl)piperidin-1-ium-4-yl]piperidin-1-ium-3-carboxamide Openeye Name: (3S)-N-cyclopropyl-1-[1-(2-quinolylmethyl)piperidin-1-ium-4-yl]piperidin-1-ium-3-carboxamide CAS Name: (3S)-N-cyclopropyl-1-[1-(2-quinolinylmethyl)-4-piperidin-1-iumyl]-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-N-cyclopropyl-1-[1-(quinolin-2-ylmethyl)piperidin-1-ium-4-yl]piperidin-1-ium-3-carboxamide Traditional Name: (3S)-N-cyclopropyl-1-[1-(2-quinolylmethyl)piperidin-1-ium-4-yl]piperidin-1-ium-3-carboxamide Formula: C24H34N4O+2 MolecularWeight: 394.55296

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)C2CC[NH+](CC2)CC3=NC4=CC=CC=C4C=C3)C(=O)NC5CC5

Isomeric SMILES

C1C[C@@H](C[NH+](C1)C2CC[NH+](CC2)CC3=NC4=CC=CC=C4C=C3)C(=O)NC5CC5

InChI

InChI=1S/C24H32N4O/c29-24(26-20-9-10-20)19-5-3-13-28(16-19)22-11-14-27(15-12-22)17-21-8-7-18-4-1-2-6-23(18)25-21/h1-2,4,6-8,19-20,22H,3,5,9-17H2,(H,26,29)/p+2/t19-/m0/s1