[7-chloranyl-2-oxidanylidene-1-(2-phenoxyethyl)quinolin-3-yl]methyl-(1-ethoxycarbonylpiperidin-4-yl)azanium

Systemtic Name: [7-chloranyl-2-oxidanylidene-1-(2-phenoxyethyl)quinolin-3-yl]methyl-(1-ethoxycarbonylpiperidin-4-yl)azanium Openeye Name: [7-chloro-2-oxo-1-(2-phenoxyethyl)-3-quinolyl]methyl-(1-ethoxycarbonyl-4-piperidyl)ammonium CAS Name: [7-chloro-2-oxo-1-(2-phenoxyethyl)-3-quinolinyl]methyl-(1-ethoxycarbonyl-4-piperidinyl)ammonium IUPAC Name: [7-chloro-2-oxo-1-(2-phenoxyethyl)quinolin-3-yl]methyl-(1-ethoxycarbonylpiperidin-4-yl)azanium Traditional Name: (1-carbethoxy-4-piperidyl)-[[7-chloro-2-keto-1-(2-phenoxyethyl)-3-quinolyl]methyl]ammonium Formula: C26H31ClN3O4+ MolecularWeight: 484.99504

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)[NH2+]CC2=CC3=C(C=C(C=C3)Cl)N(C2=O)CCOC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)N1CCC(CC1)[NH2+]CC2=CC3=C(C=C(C=C3)Cl)N(C2=O)CCOC4=CC=CC=C4

InChI

InChI=1S/C26H30ClN3O4/c1-2-33-26(32)29-12-10-22(11-13-29)28-18-20-16-19-8-9-21(27)17-24(19)30(25(20)31)14-15-34-23-6-4-3-5-7-23/h3-9,16-17,22,28H,2,10-15,18H2,1H3/p+1