(6-methoxynaphthalen-2-yl)-[(3S)-1-(1-oxidanidylpyridin-1-ium-3-yl)carbonylpiperidin-3-yl]methanone

Systemtic Name: (6-methoxynaphthalen-2-yl)-[(3S)-1-(1-oxidanidylpyridin-1-ium-3-yl)carbonylpiperidin-3-yl]methanone Openeye Name: (6-methoxy-2-naphthyl)-[(3S)-1-(1-oxidopyridin-1-ium-3-carbonyl)-3-piperidyl]methanone CAS Name: (6-methoxy-2-naphthalenyl)-[(3S)-1-[(1-oxido-3-pyridin-1-iumyl)-oxomethyl]-3-piperidinyl]methanone IUPAC Name: (6-methoxynaphthalen-2-yl)-[(3S)-1-(1-oxidopyridin-1-ium-3-carbonyl)piperidin-3-yl]methanone Traditional Name: (6-methoxy-2-naphthyl)-[(3S)-1-(1-oxidopyridin-1-ium-3-carbonyl)-3-piperidyl]methanone Formula: C23H22N2O4 MolecularWeight: 390.43178

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=C(C=C2)C(=O)C3CCCN(C3)C(=O)C4=C[N+](=CC=C4)[O-]

Isomeric SMILES

COC1=CC2=C(C=C1)C=C(C=C2)C(=O)[C@H]3CCCN(C3)C(=O)C4=C[N+](=CC=C4)[O-]

InChI

InChI=1S/C23H22N2O4/c1-29-21-9-8-16-12-18(7-6-17(16)13-21)22(26)19-4-2-10-24(14-19)23(27)20-5-3-11-25(28)15-20/h3,5-9,11-13,15,19H,2,4,10,14H2,1H3/t19-/m0/s1