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

Systemtic Name: 4-[(2R)-2-ethyl-3-oxidanylidene-4-prop-2-enyl-1,4-benzoxazin-6-yl]-4-oxidanylidene-butanoate Openeye Name: 4-[(2R)-4-allyl-2-ethyl-3-oxo-1,4-benzoxazin-6-yl]-4-oxo-butanoate CAS Name: 4-[(2R)-2-ethyl-3-oxo-4-prop-2-enyl-1,4-benzoxazin-6-yl]-4-oxobutanoate IUPAC Name: 4-[(2R)-2-ethyl-3-oxo-4-prop-2-enyl-1,4-benzoxazin-6-yl]-4-oxobutanoate Traditional Name: 4-[(2R)-4-allyl-2-ethyl-3-keto-1,4-benzoxazin-6-yl]-4-keto-butyrate Formula: C17H18NO5- MolecularWeight: 316.32852

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19NO5/c1-3-9-18-12-10-11(13(19)6-8-16(20)21)5-7-15(12)23-14(4-2)17(18)22/h3,5,7,10,14H,1,4,6,8-9H2,2H3,(H,20,21)/p-1/t14-/m1/s1