2-[[1-(1-benzothiophen-3-ylmethoxy)naphthalen-2-yl]carbonylamino]-2-methyl-butanoic acid

Systemtic Name: 2-[[1-(1-benzothiophen-3-ylmethoxy)naphthalen-2-yl]carbonylamino]-2-methyl-butanoic acid Openeye Name: 2-[[1-(benzothiophen-3-ylmethoxy)naphthalene-2-carbonyl]amino]-2-methyl-butanoic acid CAS Name: 2-[[[1-(1-benzothiophen-3-ylmethoxy)-2-naphthalenyl]-oxomethyl]amino]-2-methylbutanoic acid IUPAC Name: 2-[[1-(1-benzothiophen-3-ylmethoxy)naphthalene-2-carbonyl]amino]-2-methylbutanoic acid Traditional Name: 2-[[1-(benzothiophen-3-ylmethoxy)-2-naphthoyl]amino]-2-methyl-butyric acid Formula: C25H23NO4S MolecularWeight: 433.51942

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C(=O)O)NC(=O)C1=C(C2=CC=CC=C2C=C1)OCC3=CSC4=CC=CC=C43

Isomeric SMILES

CCC(C)(C(=O)O)NC(=O)C1=C(C2=CC=CC=C2C=C1)OCC3=CSC4=CC=CC=C43

InChI

InChI=1S/C25H23NO4S/c1-3-25(2,24(28)29)26-23(27)20-13-12-16-8-4-5-10-19(16)22(20)30-14-17-15-31-21-11-7-6-9-18(17)21/h4-13,15H,3,14H2,1-2H3,(H,26,27)(H,28,29)