ethanoyl-methyl-[4-[(2-methylphenyl)carbamoylamino]phenyl]-(4-oxidanyl-4-oxidanylidene-3-piperidin-4-yl-butyl)azanium

Systemtic Name: ethanoyl-methyl-[4-[(2-methylphenyl)carbamoylamino]phenyl]-(4-oxidanyl-4-oxidanylidene-3-piperidin-4-yl-butyl)azanium Openeye Name: acetyl-[4-hydroxy-4-oxo-3-(4-piperidyl)butyl]-methyl-[4-(o-tolylcarbamoylamino)phenyl]ammonium CAS Name: acetyl-[4-hydroxy-4-oxo-3-(4-piperidinyl)butyl]-methyl-[4-[[(2-methylanilino)-oxomethyl]amino]phenyl]ammonium IUPAC Name: acetyl-(4-hydroxy-4-oxo-3-piperidin-4-ylbutyl)-methyl-[4-[(2-methylphenyl)carbamoylamino]phenyl]azanium Traditional Name: acetyl-[4-hydroxy-4-keto-3-(4-piperidyl)butyl]-methyl-[4-(o-tolylcarbamoylamino)phenyl]ammonium Formula: C26H35N4O4+ MolecularWeight: 467.5805

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)NC2=CC=C(C=C2)[N+](C)(CCC(C3CCNCC3)C(=O)O)C(=O)C

Isomeric SMILES

CC1=CC=CC=C1NC(=O)NC2=CC=C(C=C2)[N+](C)(CCC(C3CCNCC3)C(=O)O)C(=O)C

InChI

InChI=1S/C26H34N4O4/c1-18-6-4-5-7-24(18)29-26(34)28-21-8-10-22(11-9-21)30(3,19(2)31)17-14-23(25(32)33)20-12-15-27-16-13-20/h4-11,20,23,27H,12-17H2,1-3H3,(H2-,28,29,32,33,34)/p+1