methyl 2-[(7-fluoranyl-3-oxidanylidene-4-prop-2-ynyl-1,4-benzoxazin-6-yl)carbamoyloxy]-3-methyl-but-3-enoate

Systemtic Name: methyl 2-[(7-fluoranyl-3-oxidanylidene-4-prop-2-ynyl-1,4-benzoxazin-6-yl)carbamoyloxy]-3-methyl-but-3-enoate Openeye Name: methyl 2-[(7-fluoro-3-oxo-4-prop-2-ynyl-1,4-benzoxazin-6-yl)carbamoyloxy]-3-methyl-but-3-enoate CAS Name: 2-[[(7-fluoro-3-oxo-4-prop-2-ynyl-1,4-benzoxazin-6-yl)amino]-oxomethoxy]-3-methyl-3-butenoic acid methyl ester IUPAC Name: methyl 2-[(7-fluoro-3-oxo-4-prop-2-ynyl-1,4-benzoxazin-6-yl)carbamoyloxy]-3-methylbut-3-enoate Traditional Name: 2-[(7-fluoro-3-keto-4-propargyl-1,4-benzoxazin-6-yl)carbamoyloxy]-3-methyl-but-3-enoic acid methyl ester Formula: C18H17FN2O6 MolecularWeight: 376.335783

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(C(=O)OC)OC(=O)NC1=C(C=C2C(=C1)N(C(=O)CO2)CC#C)F

Isomeric SMILES

CC(=C)C(C(=O)OC)OC(=O)NC1=C(C=C2C(=C1)N(C(=O)CO2)CC#C)F

InChI

InChI=1S/C18H17FN2O6/c1-5-6-21-13-8-12(11(19)7-14(13)26-9-15(21)22)20-18(24)27-16(10(2)3)17(23)25-4/h1,7-8,16H,2,6,9H2,3-4H3,(H,20,24)