[2-(3,4-dihydro-2H-chromen-4-ylamino)-2-oxidanylidene-ethyl] 3-(thiophen-3-ylcarbonylamino)propanoate

Systemtic Name: [2-(3,4-dihydro-2H-chromen-4-ylamino)-2-oxidanylidene-ethyl] 3-(thiophen-3-ylcarbonylamino)propanoate Openeye Name: [2-(chroman-4-ylamino)-2-oxo-ethyl] 3-(thiophene-3-carbonylamino)propanoate CAS Name: 3-[[oxo(3-thiophenyl)methyl]amino]propanoic acid [2-(3,4-dihydro-2H-1-benzopyran-4-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dihydro-2H-chromen-4-ylamino)-2-oxoethyl] 3-(thiophene-3-carbonylamino)propanoate Traditional Name: 3-(3-thenoylamino)propionic acid [2-(chroman-4-ylamino)-2-keto-ethyl] ester Formula: C19H20N2O5S MolecularWeight: 388.4375

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=CC=CC=C2C1NC(=O)COC(=O)CCNC(=O)C3=CSC=C3

Isomeric SMILES

C1COC2=CC=CC=C2C1NC(=O)COC(=O)CCNC(=O)C3=CSC=C3

InChI

InChI=1S/C19H20N2O5S/c22-17(21-15-6-9-25-16-4-2-1-3-14(15)16)11-26-18(23)5-8-20-19(24)13-7-10-27-12-13/h1-4,7,10,12,15H,5-6,8-9,11H2,(H,20,24)(H,21,22)