3-[(6,7-dimethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl-(phenylcarbamoyl)amino]propyl-diethyl-azanium

Systemtic Name: 3-[(6,7-dimethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl-(phenylcarbamoyl)amino]propyl-diethyl-azanium Openeye Name: 3-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl-(phenylcarbamoyl)amino]propyl-diethyl-ammonium CAS Name: 3-[[anilino(oxo)methyl]-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]amino]propyl-diethylammonium IUPAC Name: 3-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl-(phenylcarbamoyl)amino]propyl-diethylazanium Traditional Name: diethyl-[3-[(2-keto-6,7-dimethoxy-1H-quinolin-3-yl)methyl-(phenylcarbamoyl)amino]propyl]ammonium Formula: C26H35N4O4+ MolecularWeight: 467.5805

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCN(CC1=CC2=CC(=C(C=C2NC1=O)OC)OC)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CC[NH+](CC)CCCN(CC1=CC2=CC(=C(C=C2NC1=O)OC)OC)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C26H34N4O4/c1-5-29(6-2)13-10-14-30(26(32)27-21-11-8-7-9-12-21)18-20-15-19-16-23(33-3)24(34-4)17-22(19)28-25(20)31/h7-9,11-12,15-17H,5-6,10,13-14,18H2,1-4H3,(H,27,32)(H,28,31)/p+1