2-(3-naphthalen-2-ylpropanoylamino)-5-thiophen-3-yl-cyclohexene-1-carboxylic acid

Systemtic Name: 2-(3-naphthalen-2-ylpropanoylamino)-5-thiophen-3-yl-cyclohexene-1-carboxylic acid Openeye Name: 2-[3-(2-naphthyl)propanoylamino]-5-(3-thienyl)cyclohexene-1-carboxylic acid CAS Name: 2-[[3-(2-naphthalenyl)-1-oxopropyl]amino]-5-(3-thiophenyl)-1-cyclohexenecarboxylic acid IUPAC Name: 2-(3-naphthalen-2-ylpropanoylamino)-5-thiophen-3-ylcyclohexene-1-carboxylic acid Traditional Name: 2-[3-(2-naphthyl)propanoylamino]-5-(3-thienyl)cyclohexene-1-carboxylic acid Formula: C24H23NO3S MolecularWeight: 405.50932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(=C(CC1C2=CSC=C2)C(=O)O)NC(=O)CCC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CC(=C(CC1C2=CSC=C2)C(=O)O)NC(=O)CCC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C24H23NO3S/c26-23(10-6-16-5-7-17-3-1-2-4-18(17)13-16)25-22-9-8-19(14-21(22)24(27)28)20-11-12-29-15-20/h1-5,7,11-13,15,19H,6,8-10,14H2,(H,25,26)(H,27,28)