(4-methyl-1,4-diazepan-4-ium-1-yl)-[4-(1-pyridin-3-ylcarbonylpiperidin-4-yl)oxyphenyl]methanone

Systemtic Name: (4-methyl-1,4-diazepan-4-ium-1-yl)-[4-(1-pyridin-3-ylcarbonylpiperidin-4-yl)oxyphenyl]methanone Openeye Name: (4-methyl-1,4-diazepan-4-ium-1-yl)-[4-[[1-(pyridine-3-carbonyl)-4-piperidyl]oxy]phenyl]methanone CAS Name: (4-methyl-1,4-diazepan-4-ium-1-yl)-[4-[[1-[oxo(3-pyridinyl)methyl]-4-piperidinyl]oxy]phenyl]methanone IUPAC Name: (4-methyl-1,4-diazepan-4-ium-1-yl)-[4-[1-(pyridine-3-carbonyl)piperidin-4-yl]oxyphenyl]methanone Traditional Name: (4-methyl-1,4-diazepan-4-ium-1-yl)-[4-[(1-nicotinoyl-4-piperidyl)oxy]phenyl]methanone Formula: C24H31N4O3+ MolecularWeight: 423.52794

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCN(CC1)C(=O)C2=CC=C(C=C2)OC3CCN(CC3)C(=O)C4=CN=CC=C4

Isomeric SMILES

C[NH+]1CCCN(CC1)C(=O)C2=CC=C(C=C2)OC3CCN(CC3)C(=O)C4=CN=CC=C4

InChI

InChI=1S/C24H30N4O3/c1-26-12-3-13-27(17-16-26)23(29)19-5-7-21(8-6-19)31-22-9-14-28(15-10-22)24(30)20-4-2-11-25-18-20/h2,4-8,11,18,22H,3,9-10,12-17H2,1H3/p+1