5-(6-methylhept-5-en-2-yl)-2-(octoxycarbonylamino)thiophene-3-carboxylic acid

Systemtic Name: 5-(6-methylhept-5-en-2-yl)-2-(octoxycarbonylamino)thiophene-3-carboxylic acid Openeye Name: 5-(1,5-dimethylhex-4-enyl)-2-(octoxycarbonylamino)thiophene-3-carboxylic acid CAS Name: 5-(6-methylhept-5-en-2-yl)-2-[[octoxy(oxo)methyl]amino]-3-thiophenecarboxylic acid IUPAC Name: 5-(6-methylhept-5-en-2-yl)-2-(octoxycarbonylamino)thiophene-3-carboxylic acid Traditional Name: 5-(1,5-dimethylhex-4-enyl)-2-(octoxycarbonylamino)-3-thenoic acid Formula: C22H35NO4S MolecularWeight: 409.5826

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)NC1=C(C=C(S1)C(C)CCC=C(C)C)C(=O)O

Isomeric SMILES

CCCCCCCCOC(=O)NC1=C(C=C(S1)C(C)CCC=C(C)C)C(=O)O

InChI

InChI=1S/C22H35NO4S/c1-5-6-7-8-9-10-14-27-22(26)23-20-18(21(24)25)15-19(28-20)17(4)13-11-12-16(2)3/h12,15,17H,5-11,13-14H2,1-4H3,(H,23,26)(H,24,25)