4-[(4-naphthalen-2-yl-3-propan-2-yloxycarbonyl-thiophen-2-yl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(4-naphthalen-2-yl-3-propan-2-yloxycarbonyl-thiophen-2-yl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[3-isopropoxycarbonyl-4-(2-naphthyl)-2-thienyl]amino]-4-oxo-butanoic acid CAS Name: 4-[[4-(2-naphthalenyl)-3-[oxo(propan-2-yloxy)methyl]-2-thiophenyl]amino]-4-oxobutanoic acid IUPAC Name: 4-[(4-naphthalen-2-yl-3-propan-2-yloxycarbonylthiophen-2-yl)amino]-4-oxobutanoic acid Traditional Name: 4-[[3-isopropoxycarbonyl-4-(2-naphthyl)-2-thienyl]amino]-4-keto-butyric acid Formula: C22H21NO5S MolecularWeight: 411.47084

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=C(SC=C1C2=CC3=CC=CC=C3C=C2)NC(=O)CCC(=O)O

Isomeric SMILES

CC(C)OC(=O)C1=C(SC=C1C2=CC3=CC=CC=C3C=C2)NC(=O)CCC(=O)O

InChI

InChI=1S/C22H21NO5S/c1-13(2)28-22(27)20-17(12-29-21(20)23-18(24)9-10-19(25)26)16-8-7-14-5-3-4-6-15(14)11-16/h3-8,11-13H,9-10H2,1-2H3,(H,23,24)(H,25,26)