2-[[4-(4-butylphenyl)-3-methoxycarbonyl-thiophen-2-yl]carbamoyl]cyclohexane-1-carboxylic acid

Systemtic Name: 2-[[4-(4-butylphenyl)-3-methoxycarbonyl-thiophen-2-yl]carbamoyl]cyclohexane-1-carboxylic acid Openeye Name: 2-[[4-(4-butylphenyl)-3-methoxycarbonyl-2-thienyl]carbamoyl]cyclohexanecarboxylic acid CAS Name: 2-[[[4-(4-butylphenyl)-3-methoxycarbonyl-2-thiophenyl]amino]-oxomethyl]-1-cyclohexanecarboxylic acid IUPAC Name: 2-[[4-(4-butylphenyl)-3-methoxycarbonylthiophen-2-yl]carbamoyl]cyclohexane-1-carboxylic acid Traditional Name: 2-[[4-(4-butylphenyl)-3-carbomethoxy-2-thienyl]carbamoyl]cyclohexanecarboxylic acid Formula: C24H29NO5S MolecularWeight: 443.55576

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)C3CCCCC3C(=O)O

Isomeric SMILES

CCCCC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)C3CCCCC3C(=O)O

InChI

InChI=1S/C24H29NO5S/c1-3-4-7-15-10-12-16(13-11-15)19-14-31-22(20(19)24(29)30-2)25-21(26)17-8-5-6-9-18(17)23(27)28/h10-14,17-18H,3-9H2,1-2H3,(H,25,26)(H,27,28)