N-[(5-chloranyl-8-oxidanyl-quinolin-1-ium-7-yl)-(4-methoxyphenyl)methyl]-3,4,5-trimethoxy-benzamide

Systemtic Name: N-[(5-chloranyl-8-oxidanyl-quinolin-1-ium-7-yl)-(4-methoxyphenyl)methyl]-3,4,5-trimethoxy-benzamide Openeye Name: N-[(5-chloro-8-hydroxy-quinolin-1-ium-7-yl)-(4-methoxyphenyl)methyl]-3,4,5-trimethoxy-benzamide CAS Name: N-[(5-chloro-8-hydroxy-7-quinolin-1-iumyl)-(4-methoxyphenyl)methyl]-3,4,5-trimethoxybenzamide IUPAC Name: N-[(5-chloro-8-hydroxyquinolin-1-ium-7-yl)-(4-methoxyphenyl)methyl]-3,4,5-trimethoxybenzamide Traditional Name: N-[(5-chloro-8-hydroxy-quinolin-1-ium-7-yl)-(4-methoxyphenyl)methyl]-3,4,5-trimethoxy-benzamide Formula: C27H26ClN2O6+ MolecularWeight: 509.95814

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2=CC(=C3C=CC=[NH+]C3=C2O)Cl)NC(=O)C4=CC(=C(C(=C4)OC)OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)C(C2=CC(=C3C=CC=[NH+]C3=C2O)Cl)NC(=O)C4=CC(=C(C(=C4)OC)OC)OC

InChI

InChI=1S/C27H25ClN2O6/c1-33-17-9-7-15(8-10-17)23(19-14-20(28)18-6-5-11-29-24(18)25(19)31)30-27(32)16-12-21(34-2)26(36-4)22(13-16)35-3/h5-14,23,31H,1-4H3,(H,30,32)/p+1