[4,7-dimethyl-2-oxidanylidene-3-[2-oxidanylidene-2-(2-thiophen-3-ylethylamino)ethyl]chromen-5-yl] ethanoate

Systemtic Name: [4,7-dimethyl-2-oxidanylidene-3-[2-oxidanylidene-2-(2-thiophen-3-ylethylamino)ethyl]chromen-5-yl] ethanoate Openeye Name: [4,7-dimethyl-2-oxo-3-[2-oxo-2-[2-(3-thienyl)ethylamino]ethyl]chromen-5-yl] acetate CAS Name: acetic acid [4,7-dimethyl-2-oxo-3-[2-oxo-2-[2-(3-thiophenyl)ethylamino]ethyl]-1-benzopyran-5-yl] ester IUPAC Name: [4,7-dimethyl-2-oxo-3-[2-oxo-2-(2-thiophen-3-ylethylamino)ethyl]chromen-5-yl] acetate Traditional Name: acetic acid [2-keto-3-[2-keto-2-[2-(3-thienyl)ethylamino]ethyl]-4,7-dimethyl-chromen-5-yl] ester Formula: C21H21NO5S MolecularWeight: 399.46014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C(C(=O)O2)CC(=O)NCCC3=CSC=C3)C)C(=C1)OC(=O)C

Isomeric SMILES

CC1=CC2=C(C(=C(C(=O)O2)CC(=O)NCCC3=CSC=C3)C)C(=C1)OC(=O)C

InChI

InChI=1S/C21H21NO5S/c1-12-8-17(26-14(3)23)20-13(2)16(21(25)27-18(20)9-12)10-19(24)22-6-4-15-5-7-28-11-15/h5,7-9,11H,4,6,10H2,1-3H3,(H,22,24)