6-[[3-methoxycarbonyl-4-(4-propan-2-ylphenyl)thiophen-2-yl]carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylic acid

Systemtic Name: 6-[[3-methoxycarbonyl-4-(4-propan-2-ylphenyl)thiophen-2-yl]carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylic acid Openeye Name: 6-[[4-(4-isopropylphenyl)-3-methoxycarbonyl-2-thienyl]carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylic acid CAS Name: 6-[[[3-methoxycarbonyl-4-(4-propan-2-ylphenyl)-2-thiophenyl]amino]-oxomethyl]-3,4-dimethyl-1-cyclohex-3-enecarboxylic acid IUPAC Name: 6-[[3-methoxycarbonyl-4-(4-propan-2-ylphenyl)thiophen-2-yl]carbamoyl]-3,4-dimethylcyclohex-3-ene-1-carboxylic acid Traditional Name: 6-[(3-carbomethoxy-4-p-cumenyl-2-thienyl)carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylic acid Formula: C25H29NO5S MolecularWeight: 455.56646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC(C(C1)C(=O)NC2=C(C(=CS2)C3=CC=C(C=C3)C(C)C)C(=O)OC)C(=O)O)C

Isomeric SMILES

CC1=C(CC(C(C1)C(=O)NC2=C(C(=CS2)C3=CC=C(C=C3)C(C)C)C(=O)OC)C(=O)O)C

InChI

InChI=1S/C25H29NO5S/c1-13(2)16-6-8-17(9-7-16)20-12-32-23(21(20)25(30)31-5)26-22(27)18-10-14(3)15(4)11-19(18)24(28)29/h6-9,12-13,18-19H,10-11H2,1-5H3,(H,26,27)(H,28,29)