7-chloranyl-3-methyl-quinoline-8-carboxylic acid; 4-methyl-2,3-dipropyl-aniline

Systemtic Name: 7-chloranyl-3-methyl-quinoline-8-carboxylic acid; 4-methyl-2,3-dipropyl-aniline Openeye Name: 7-chloro-3-methyl-quinoline-8-carboxylic acid; 4-methyl-2,3-dipropyl-aniline CAS Name: 7-chloro-3-methyl-8-quinolinecarboxylic acid; 4-methyl-2,3-dipropylaniline IUPAC Name: 7-chloro-3-methylquinoline-8-carboxylic acid; 4-methyl-2,3-dipropylaniline Traditional Name: 7-chloro-3-methyl-quinoline-8-carboxylic acid; (4-methyl-2,3-dipropyl-phenyl)amine Formula: C24H29ClN2O2 MolecularWeight: 412.95226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1CCC)N)C.CC1=CN=C2C(=C1)C=CC(=C2C(=O)O)Cl

Isomeric SMILES

CCCC1=C(C=CC(=C1CCC)N)C.CC1=CN=C2C(=C1)C=CC(=C2C(=O)O)Cl

InChI

InChI=1S/C13H21N.C11H8ClNO2/c1-4-6-11-10(3)8-9-13(14)12(11)7-5-2;1-6-4-7-2-3-8(12)9(11(14)15)10(7)13-5-6/h8-9H,4-7,14H2,1-3H3;2-5H,1H3,(H,14,15)