2-[3-(6-oxidanylnaphthalen-2-yl)propanoylamino]-5-thiophen-3-yl-cyclohexene-1-carboxylic acid

Systemtic Name: 2-[3-(6-oxidanylnaphthalen-2-yl)propanoylamino]-5-thiophen-3-yl-cyclohexene-1-carboxylic acid Openeye Name: 2-[3-(6-hydroxy-2-naphthyl)propanoylamino]-5-(3-thienyl)cyclohexene-1-carboxylic acid CAS Name: 2-[[3-(6-hydroxy-2-naphthalenyl)-1-oxopropyl]amino]-5-(3-thiophenyl)-1-cyclohexenecarboxylic acid IUPAC Name: 2-[3-(6-hydroxynaphthalen-2-yl)propanoylamino]-5-thiophen-3-ylcyclohexene-1-carboxylic acid Traditional Name: 2-[3-(6-hydroxy-2-naphthyl)propanoylamino]-5-(3-thienyl)cyclohexene-1-carboxylic acid Formula: C24H23NO4S MolecularWeight: 421.50872

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=C(CC1C2=CSC=C2)C(=O)O)NC(=O)CCC3=CC4=C(C=C3)C=C(C=C4)O

Isomeric SMILES

C1CC(=C(CC1C2=CSC=C2)C(=O)O)NC(=O)CCC3=CC4=C(C=C3)C=C(C=C4)O

InChI

InChI=1S/C24H23NO4S/c26-20-6-4-16-11-15(1-3-17(16)12-20)2-8-23(27)25-22-7-5-18(13-21(22)24(28)29)19-9-10-30-14-19/h1,3-4,6,9-12,14,18,26H,2,5,7-8,13H2,(H,25,27)(H,28,29)