2-[4-[2-azanyl-3-(5-chloranyl-3-methoxy-thiophen-2-yl)-3-oxidanylidene-propyl]phenyl]ethanoic acid

Systemtic Name: 2-[4-[2-azanyl-3-(5-chloranyl-3-methoxy-thiophen-2-yl)-3-oxidanylidene-propyl]phenyl]ethanoic acid Openeye Name: 2-[4-[2-amino-3-(5-chloro-3-methoxy-2-thienyl)-3-oxo-propyl]phenyl]acetic acid CAS Name: 2-[4-[2-amino-3-(5-chloro-3-methoxy-2-thiophenyl)-3-oxopropyl]phenyl]acetic acid IUPAC Name: 2-[4-[2-amino-3-(5-chloro-3-methoxythiophen-2-yl)-3-oxopropyl]phenyl]acetic acid Traditional Name: 2-[4-[2-amino-3-(5-chloro-3-methoxy-2-thienyl)-3-keto-propyl]phenyl]acetic acid Formula: C16H16ClNO4S MolecularWeight: 353.82054

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(SC(=C1)Cl)C(=O)C(CC2=CC=C(C=C2)CC(=O)O)N

Isomeric SMILES

COC1=C(SC(=C1)Cl)C(=O)C(CC2=CC=C(C=C2)CC(=O)O)N

InChI

InChI=1S/C16H16ClNO4S/c1-22-12-8-13(17)23-16(12)15(21)11(18)6-9-2-4-10(5-3-9)7-14(19)20/h2-5,8,11H,6-7,18H2,1H3,(H,19,20)