4-[[(2R)-2-ethyl-4-(2-methylprop-2-enyl)-3-oxidanylidene-1,4-benzoxazin-6-yl]amino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[[(2R)-2-ethyl-4-(2-methylprop-2-enyl)-3-oxidanylidene-1,4-benzoxazin-6-yl]amino]-4-oxidanylidene-butanoate Openeye Name: 4-[[(2R)-2-ethyl-4-(2-methylallyl)-3-oxo-1,4-benzoxazin-6-yl]amino]-4-oxo-butanoate CAS Name: 4-[[(2R)-2-ethyl-4-(2-methylprop-2-enyl)-3-oxo-1,4-benzoxazin-6-yl]amino]-4-oxobutanoate IUPAC Name: 4-[[(2R)-2-ethyl-4-(2-methylprop-2-enyl)-3-oxo-1,4-benzoxazin-6-yl]amino]-4-oxobutanoate Traditional Name: 4-[[(2R)-2-ethyl-3-keto-4-(2-methylallyl)-1,4-benzoxazin-6-yl]amino]-4-keto-butyrate Formula: C18H21N2O5- MolecularWeight: 345.36974

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(C2=C(O1)C=CC(=C2)NC(=O)CCC(=O)[O-])CC(=C)C

Isomeric SMILES

CC[C@@H]1C(=O)N(C2=C(O1)C=CC(=C2)NC(=O)CCC(=O)[O-])CC(=C)C

InChI

InChI=1S/C18H22N2O5/c1-4-14-18(24)20(10-11(2)3)13-9-12(5-6-15(13)25-14)19-16(21)7-8-17(22)23/h5-6,9,14H,2,4,7-8,10H2,1,3H3,(H,19,21)(H,22,23)/p-1/t14-/m1/s1