ethyl 2-[[6-[(2-ethoxy-2-oxidanylidene-ethyl)carbamoyl]phenoxathiin-4-yl]carbonylamino]ethanoate

Systemtic Name: ethyl 2-[[6-[(2-ethoxy-2-oxidanylidene-ethyl)carbamoyl]phenoxathiin-4-yl]carbonylamino]ethanoate Openeye Name: ethyl 2-[[6-[(2-ethoxy-2-oxo-ethyl)carbamoyl]phenoxathiine-4-carbonyl]amino]acetate CAS Name: 2-[[[6-[[(2-ethoxy-2-oxoethyl)amino]-oxomethyl]-4-phenoxathiinyl]-oxomethyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[6-[(2-ethoxy-2-oxoethyl)carbamoyl]phenoxathiine-4-carbonyl]amino]acetate Traditional Name: 2-[[6-[(2-ethoxy-2-keto-ethyl)carbamoyl]phenoxathiine-4-carbonyl]amino]acetic acid ethyl ester Formula: C22H22N2O7S MolecularWeight: 458.48428

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=O)C1=C2C(=CC=C1)SC3=CC=CC(=C3O2)C(=O)NCC(=O)OCC

Isomeric SMILES

CCOC(=O)CNC(=O)C1=C2C(=CC=C1)SC3=CC=CC(=C3O2)C(=O)NCC(=O)OCC

InChI

InChI=1S/C22H22N2O7S/c1-3-29-17(25)11-23-21(27)13-7-5-9-15-19(13)31-20-14(8-6-10-16(20)32-15)22(28)24-12-18(26)30-4-2/h5-10H,3-4,11-12H2,1-2H3,(H,23,27)(H,24,28)