2-azanyl-2-methoxycarbonyl-3-[(4-prop-1-en-2-ylcyclohexen-1-yl)methyl]-6-(trifluoromethyl)-3,4-dihydroquinoline-1-carboxylic acid

Systemtic Name: 2-azanyl-2-methoxycarbonyl-3-[(4-prop-1-en-2-ylcyclohexen-1-yl)methyl]-6-(trifluoromethyl)-3,4-dihydroquinoline-1-carboxylic acid Openeye Name: 2-amino-3-[(4-isopropenylcyclohexen-1-yl)methyl]-2-methoxycarbonyl-6-(trifluoromethyl)-3,4-dihydroquinoline-1-carboxylic acid CAS Name: 2-amino-2-methoxycarbonyl-3-[[4-(1-methylethenyl)-1-cyclohexenyl]methyl]-6-(trifluoromethyl)-3,4-dihydroquinoline-1-carboxylic acid IUPAC Name: 2-amino-2-methoxycarbonyl-3-[(4-prop-1-en-2-ylcyclohexen-1-yl)methyl]-6-(trifluoromethyl)-3,4-dihydroquinoline-1-carboxylic acid Traditional Name: 2-amino-2-carbomethoxy-3-[(4-isopropenylcyclohexen-1-yl)methyl]-6-(trifluoromethyl)-3,4-dihydroquinoline-1-carboxylic acid Formula: C23H27F3N2O4 MolecularWeight: 452.46669

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C1CCC(=CC1)CC2CC3=C(C=CC(=C3)C(F)(F)F)N(C2(C(=O)OC)N)C(=O)O

Isomeric SMILES

CC(=C)C1CCC(=CC1)CC2CC3=C(C=CC(=C3)C(F)(F)F)N(C2(C(=O)OC)N)C(=O)O

InChI

InChI=1S/C23H27F3N2O4/c1-13(2)15-6-4-14(5-7-15)10-18-12-16-11-17(23(24,25)26)8-9-19(16)28(21(30)31)22(18,27)20(29)32-3/h4,8-9,11,15,18H,1,5-7,10,12,27H2,2-3H3,(H,30,31)