2-azanyl-2-cyclopropyl-3-methoxycarbonyl-3-[(E)-2-methylhept-5-enyl]-6-(trifluoromethyl)-4H-quinoline-1-carboxylic acid

Systemtic Name: 2-azanyl-2-cyclopropyl-3-methoxycarbonyl-3-[(E)-2-methylhept-5-enyl]-6-(trifluoromethyl)-4H-quinoline-1-carboxylic acid Openeye Name: 2-amino-2-cyclopropyl-3-methoxycarbonyl-3-[(E)-2-methylhept-5-enyl]-6-(trifluoromethyl)-4H-quinoline-1-carboxylic acid CAS Name: 2-amino-2-cyclopropyl-3-methoxycarbonyl-3-[(E)-2-methylhept-5-enyl]-6-(trifluoromethyl)-4H-quinoline-1-carboxylic acid IUPAC Name: 2-amino-2-cyclopropyl-3-methoxycarbonyl-3-[(E)-2-methylhept-5-enyl]-6-(trifluoromethyl)-4H-quinoline-1-carboxylic acid Traditional Name: 2-amino-3-carbomethoxy-2-cyclopropyl-3-[(E)-2-methylhept-5-enyl]-6-(trifluoromethyl)-4H-quinoline-1-carboxylic acid Formula: C24H31F3N2O4 MolecularWeight: 468.50915

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Descriptors Computed from Structure

Canonical SMILES:

CC=CCCC(C)CC1(CC2=C(C=CC(=C2)C(F)(F)F)N(C1(C3CC3)N)C(=O)O)C(=O)OC

Isomeric SMILES

C/C=C/CCC(C)CC1(CC2=C(C=CC(=C2)C(F)(F)F)N(C1(C3CC3)N)C(=O)O)C(=O)OC

InChI

InChI=1S/C24H31F3N2O4/c1-4-5-6-7-15(2)13-22(20(30)33-3)14-16-12-18(24(25,26)27)10-11-19(16)29(21(31)32)23(22,28)17-8-9-17/h4-5,10-12,15,17H,6-9,13-14,28H2,1-3H3,(H,31,32)/b5-4+