2-[[2-[(2-methoxyphenyl)amino]quinolin-4-yl]carbonylamino]ethyl-(phenylmethyl)-propan-2-yl-azanium

Systemtic Name: 2-[[2-[(2-methoxyphenyl)amino]quinolin-4-yl]carbonylamino]ethyl-(phenylmethyl)-propan-2-yl-azanium Openeye Name: benzyl-isopropyl-[2-[[2-(2-methoxyanilino)quinoline-4-carbonyl]amino]ethyl]ammonium CAS Name: 2-[[[2-(2-methoxyanilino)-4-quinolinyl]-oxomethyl]amino]ethyl-(phenylmethyl)-propan-2-ylammonium IUPAC Name: benzyl-[2-[[2-(2-methoxyanilino)quinoline-4-carbonyl]amino]ethyl]-propan-2-ylazanium Traditional Name: benzyl-isopropyl-[2-[[2-(o-anisidino)quinoline-4-carbonyl]amino]ethyl]ammonium Formula: C29H33N4O2+ MolecularWeight: 469.59792

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CCNC(=O)C1=CC(=NC2=CC=CC=C21)NC3=CC=CC=C3OC)CC4=CC=CC=C4

Isomeric SMILES

CC(C)[NH+](CCNC(=O)C1=CC(=NC2=CC=CC=C21)NC3=CC=CC=C3OC)CC4=CC=CC=C4

InChI

InChI=1S/C29H32N4O2/c1-21(2)33(20-22-11-5-4-6-12-22)18-17-30-29(34)24-19-28(31-25-14-8-7-13-23(24)25)32-26-15-9-10-16-27(26)35-3/h4-16,19,21H,17-18,20H2,1-3H3,(H,30,34)(H,31,32)/p+1