1-[6-methoxy-3-(phenylcarbonyl)quinolin-1-ium-4-yl]piperidine-4-carboxamide

Systemtic Name: 1-[6-methoxy-3-(phenylcarbonyl)quinolin-1-ium-4-yl]piperidine-4-carboxamide Openeye Name: 1-(3-benzoyl-6-methoxy-quinolin-1-ium-4-yl)piperidine-4-carboxamide CAS Name: 1-(3-benzoyl-6-methoxy-4-quinolin-1-iumyl)-4-piperidinecarboxamide IUPAC Name: 1-(3-benzoyl-6-methoxyquinolin-1-ium-4-yl)piperidine-4-carboxamide Traditional Name: 1-(3-benzoyl-6-methoxy-quinolin-1-ium-4-yl)isonipecotamide Formula: C23H24N3O3+ MolecularWeight: 390.45496

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C(=C[NH+]=C2C=C1)C(=O)C3=CC=CC=C3)N4CCC(CC4)C(=O)N

Isomeric SMILES

COC1=CC2=C(C(=C[NH+]=C2C=C1)C(=O)C3=CC=CC=C3)N4CCC(CC4)C(=O)N

InChI

InChI=1S/C23H23N3O3/c1-29-17-7-8-20-18(13-17)21(26-11-9-16(10-12-26)23(24)28)19(14-25-20)22(27)15-5-3-2-4-6-15/h2-8,13-14,16H,9-12H2,1H3,(H2,24,28)/p+1