1-[(6-ethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-3-(4-methylphenyl)urea

Systemtic Name: 1-[(6-ethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-3-(4-methylphenyl)urea Openeye Name: 1-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-3-(p-tolyl)urea CAS Name: 1-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-[[(2R)-1-ethyl-2-pyrrolidin-1-iumyl]methyl]-3-(4-methylphenyl)urea IUPAC Name: 1-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-3-(4-methylphenyl)urea Traditional Name: 1-[(6-ethoxy-2-keto-1H-quinolin-3-yl)methyl]-1-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-3-(p-tolyl)urea Formula: C27H35N4O3+ MolecularWeight: 463.5918

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CN(CC2=CC3=C(C=CC(=C3)OCC)NC2=O)C(=O)NC4=CC=C(C=C4)C

Isomeric SMILES

CC[NH+]1CCC[C@@H]1CN(CC2=CC3=C(C=CC(=C3)OCC)NC2=O)C(=O)NC4=CC=C(C=C4)C

InChI

InChI=1S/C27H34N4O3/c1-4-30-14-6-7-23(30)18-31(27(33)28-22-10-8-19(3)9-11-22)17-21-15-20-16-24(34-5-2)12-13-25(20)29-26(21)32/h8-13,15-16,23H,4-7,14,17-18H2,1-3H3,(H,28,33)(H,29,32)/p+1/t23-/m1/s1