2-(3-chloranyl-4-oxidanyl-phenyl)-2-[3-methoxy-2-oxidanylidene-3-(2-thiophen-2-ylethanoylamino)azetidin-1-yl]ethanoic acid

Systemtic Name: 2-(3-chloranyl-4-oxidanyl-phenyl)-2-[3-methoxy-2-oxidanylidene-3-(2-thiophen-2-ylethanoylamino)azetidin-1-yl]ethanoic acid Openeye Name: 2-(3-chloro-4-hydroxy-phenyl)-2-[3-methoxy-2-oxo-3-[[2-(2-thienyl)acetyl]amino]azetidin-1-yl]acetic acid CAS Name: 2-(3-chloro-4-hydroxyphenyl)-2-[3-methoxy-2-oxo-3-[(1-oxo-2-thiophen-2-ylethyl)amino]-1-azetidinyl]acetic acid IUPAC Name: 2-(3-chloro-4-hydroxyphenyl)-2-[3-methoxy-2-oxo-3-[(2-thiophen-2-ylacetyl)amino]azetidin-1-yl]acetic acid Traditional Name: 2-(3-chloro-4-hydroxy-phenyl)-2-[2-keto-3-methoxy-3-[[2-(2-thienyl)acetyl]amino]azetidin-1-yl]acetic acid Formula: C18H17ClN2O6S MolecularWeight: 424.85538

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Descriptors Computed from Structure

Canonical SMILES:

COC1(CN(C1=O)C(C2=CC(=C(C=C2)O)Cl)C(=O)O)NC(=O)CC3=CC=CS3

Isomeric SMILES

COC1(CN(C1=O)C(C2=CC(=C(C=C2)O)Cl)C(=O)O)NC(=O)CC3=CC=CS3

InChI

InChI=1S/C18H17ClN2O6S/c1-27-18(20-14(23)8-11-3-2-6-28-11)9-21(17(18)26)15(16(24)25)10-4-5-13(22)12(19)7-10/h2-7,15,22H,8-9H2,1H3,(H,20,23)(H,24,25)