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

Systemtic Name: 2-[[2-[(2,4-dimethoxyphenyl)amino]quinolin-4-yl]carbonylamino]ethyl-(phenylmethyl)-propan-2-yl-azanium Openeye Name: benzyl-[2-[[2-(2,4-dimethoxyanilino)quinoline-4-carbonyl]amino]ethyl]-isopropyl-ammonium CAS Name: 2-[[[2-(2,4-dimethoxyanilino)-4-quinolinyl]-oxomethyl]amino]ethyl-(phenylmethyl)-propan-2-ylammonium IUPAC Name: benzyl-[2-[[2-(2,4-dimethoxyanilino)quinoline-4-carbonyl]amino]ethyl]-propan-2-ylazanium Traditional Name: benzyl-[2-[[2-(2,4-dimethoxyanilino)quinoline-4-carbonyl]amino]ethyl]-isopropyl-ammonium Formula: C30H35N4O3+ MolecularWeight: 499.6239

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CCNC(=O)C1=CC(=NC2=CC=CC=C21)NC3=C(C=C(C=C3)OC)OC)CC4=CC=CC=C4

Isomeric SMILES

CC(C)[NH+](CCNC(=O)C1=CC(=NC2=CC=CC=C21)NC3=C(C=C(C=C3)OC)OC)CC4=CC=CC=C4

InChI

InChI=1S/C30H34N4O3/c1-21(2)34(20-22-10-6-5-7-11-22)17-16-31-30(35)25-19-29(32-26-13-9-8-12-24(25)26)33-27-15-14-23(36-3)18-28(27)37-4/h5-15,18-19,21H,16-17,20H2,1-4H3,(H,31,35)(H,32,33)/p+1