1-[4-[7-(4-chloranylbutoxy)-6-cyano-quinolin-4-yl]oxyphenyl]-3-(4-methoxyphenyl)urea

Systemtic Name: 1-[4-[7-(4-chloranylbutoxy)-6-cyano-quinolin-4-yl]oxyphenyl]-3-(4-methoxyphenyl)urea Openeye Name: 1-[4-[[7-(4-chlorobutoxy)-6-cyano-4-quinolyl]oxy]phenyl]-3-(4-methoxyphenyl)urea CAS Name: 1-[4-[[7-(4-chlorobutoxy)-6-cyano-4-quinolinyl]oxy]phenyl]-3-(4-methoxyphenyl)urea IUPAC Name: 1-[4-[7-(4-chlorobutoxy)-6-cyanoquinolin-4-yl]oxyphenyl]-3-(4-methoxyphenyl)urea Traditional Name: 1-[4-[[7-(4-chlorobutoxy)-6-cyano-4-quinolyl]oxy]phenyl]-3-(4-methoxyphenyl)urea Formula: C28H25ClN4O4 MolecularWeight: 516.9755

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)NC2=CC=C(C=C2)OC3=C4C=C(C(=CC4=NC=C3)OCCCCCl)C#N

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)NC2=CC=C(C=C2)OC3=C4C=C(C(=CC4=NC=C3)OCCCCCl)C#N

InChI

InChI=1S/C28H25ClN4O4/c1-35-22-8-4-20(5-9-22)32-28(34)33-21-6-10-23(11-7-21)37-26-12-14-31-25-17-27(36-15-3-2-13-29)19(18-30)16-24(25)26/h4-12,14,16-17H,2-3,13,15H2,1H3,(H2,32,33,34)