N-[3-butanoyl-4-[(2-methylphenyl)amino]quinolin-8-yl]-2,6-bis(chloranyl)benzamide

Systemtic Name: N-[3-butanoyl-4-[(2-methylphenyl)amino]quinolin-8-yl]-2,6-bis(chloranyl)benzamide Openeye Name: N-[3-butanoyl-4-(2-methylanilino)-8-quinolyl]-2,6-dichloro-benzamide CAS Name: 2,6-dichloro-N-[4-(2-methylanilino)-3-(1-oxobutyl)-8-quinolinyl]benzamide IUPAC Name: N-[3-butanoyl-4-(2-methylanilino)quinolin-8-yl]-2,6-dichlorobenzamide Traditional Name: N-[3-butyryl-4-(o-toluidino)-8-quinolyl]-2,6-dichloro-benzamide Formula: C27H23Cl2N3O2 MolecularWeight: 492.39642

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CN=C2C(=C1NC3=CC=CC=C3C)C=CC=C2NC(=O)C4=C(C=CC=C4Cl)Cl

Isomeric SMILES

CCCC(=O)C1=CN=C2C(=C1NC3=CC=CC=C3C)C=CC=C2NC(=O)C4=C(C=CC=C4Cl)Cl

InChI

InChI=1S/C27H23Cl2N3O2/c1-3-8-23(33)18-15-30-26-17(25(18)31-21-13-5-4-9-16(21)2)10-6-14-22(26)32-27(34)24-19(28)11-7-12-20(24)29/h4-7,9-15H,3,8H2,1-2H3,(H,30,31)(H,32,34)