4-oxidanylidene-4-[(4-phenyl-3-propoxycarbonyl-thiophen-2-yl)amino]butanoic acid

Systemtic Name: 4-oxidanylidene-4-[(4-phenyl-3-propoxycarbonyl-thiophen-2-yl)amino]butanoic acid Openeye Name: 4-oxo-4-[(4-phenyl-3-propoxycarbonyl-2-thienyl)amino]butanoic acid CAS Name: 4-oxo-4-[[3-[oxo(propoxy)methyl]-4-phenyl-2-thiophenyl]amino]butanoic acid IUPAC Name: 4-oxo-4-[(4-phenyl-3-propoxycarbonylthiophen-2-yl)amino]butanoic acid Traditional Name: 4-keto-4-[(4-phenyl-3-propoxycarbonyl-2-thienyl)amino]butyric acid Formula: C18H19NO5S MolecularWeight: 361.41216

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)CCC(=O)O

Isomeric SMILES

CCCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)CCC(=O)O

InChI

InChI=1S/C18H19NO5S/c1-2-10-24-18(23)16-13(12-6-4-3-5-7-12)11-25-17(16)19-14(20)8-9-15(21)22/h3-7,11H,2,8-10H2,1H3,(H,19,20)(H,21,22)