4-[(2,2-dimethyl-3-oxidanylidene-4-prop-2-enyl-1,4-benzoxazin-7-yl)amino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[(2,2-dimethyl-3-oxidanylidene-4-prop-2-enyl-1,4-benzoxazin-7-yl)amino]-4-oxidanylidene-butanoate Openeye Name: 4-[(4-allyl-2,2-dimethyl-3-oxo-1,4-benzoxazin-7-yl)amino]-4-oxo-butanoate CAS Name: 4-[(2,2-dimethyl-3-oxo-4-prop-2-enyl-1,4-benzoxazin-7-yl)amino]-4-oxobutanoate IUPAC Name: 4-[(2,2-dimethyl-3-oxo-4-prop-2-enyl-1,4-benzoxazin-7-yl)amino]-4-oxobutanoate Traditional Name: 4-[(4-allyl-3-keto-2,2-dimethyl-1,4-benzoxazin-7-yl)amino]-4-keto-butyrate Formula: C17H19N2O5- MolecularWeight: 331.34316

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)N(C2=C(O1)C=C(C=C2)NC(=O)CCC(=O)[O-])CC=C)C

Isomeric SMILES

CC1(C(=O)N(C2=C(O1)C=C(C=C2)NC(=O)CCC(=O)[O-])CC=C)C

InChI

InChI=1S/C17H20N2O5/c1-4-9-19-12-6-5-11(18-14(20)7-8-15(21)22)10-13(12)24-17(2,3)16(19)23/h4-6,10H,1,7-9H2,2-3H3,(H,18,20)(H,21,22)/p-1