(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 3-(thiophen-2-ylcarbonylamino)propanoate

Systemtic Name: (6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 3-(thiophen-2-ylcarbonylamino)propanoate Openeye Name: (6,7-dimethyl-2-oxo-chromen-4-yl)methyl 3-(thiophene-2-carbonylamino)propanoate CAS Name: 3-[[oxo(thiophen-2-yl)methyl]amino]propanoic acid (6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6,7-dimethyl-2-oxochromen-4-yl)methyl 3-(thiophene-2-carbonylamino)propanoate Traditional Name: 3-(2-thenoylamino)propionic acid (2-keto-6,7-dimethyl-chromen-4-yl)methyl ester Formula: C20H19NO5S MolecularWeight: 385.43356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)CCNC(=O)C3=CC=CS3)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)CCNC(=O)C3=CC=CS3)C

InChI

InChI=1S/C20H19NO5S/c1-12-8-15-14(10-19(23)26-16(15)9-13(12)2)11-25-18(22)5-6-21-20(24)17-4-3-7-27-17/h3-4,7-10H,5-6,11H2,1-2H3,(H,21,24)