1-[1-[4-[5-(1-oxidanidylpyridin-1-ium-4-yl)sulfonylpentoxy]phenyl]carbonylpiperidin-4-yl]-3,4-dihydroquinolin-2-one

Systemtic Name: 1-[1-[4-[5-(1-oxidanidylpyridin-1-ium-4-yl)sulfonylpentoxy]phenyl]carbonylpiperidin-4-yl]-3,4-dihydroquinolin-2-one Openeye Name: 1-[1-[4-[5-(1-oxidopyridin-1-ium-4-yl)sulfonylpentoxy]benzoyl]-4-piperidyl]-3,4-dihydroquinolin-2-one CAS Name: 1-[1-[[4-[5-[(1-oxido-4-pyridin-1-iumyl)sulfonyl]pentoxy]phenyl]-oxomethyl]-4-piperidinyl]-3,4-dihydroquinolin-2-one IUPAC Name: 1-[1-[4-[5-(1-oxidopyridin-1-ium-4-yl)sulfonylpentoxy]benzoyl]piperidin-4-yl]-3,4-dihydroquinolin-2-one Traditional Name: 1-[1-[4-[5-(1-oxidopyridin-1-ium-4-yl)sulfonylpentoxy]benzoyl]-4-piperidyl]-3,4-dihydrocarbostyril Formula: C31H35N3O6S MolecularWeight: 577.6911

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C(=O)CCC3=CC=CC=C32)C(=O)C4=CC=C(C=C4)OCCCCCS(=O)(=O)C5=CC=[N+](C=C5)[O-]

Isomeric SMILES

C1CN(CCC1N2C(=O)CCC3=CC=CC=C32)C(=O)C4=CC=C(C=C4)OCCCCCS(=O)(=O)C5=CC=[N+](C=C5)[O-]

InChI

InChI=1S/C31H35N3O6S/c35-30-13-10-24-6-2-3-7-29(24)34(30)26-14-18-32(19-15-26)31(36)25-8-11-27(12-9-25)40-22-4-1-5-23-41(38,39)28-16-20-33(37)21-17-28/h2-3,6-9,11-12,16-17,20-21,26H,1,4-5,10,13-15,18-19,22-23H2