4-[[(2S)-2-methyl-3-oxidanylidene-4-propan-2-yl-1,4-benzoxazin-6-yl]amino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[[(2S)-2-methyl-3-oxidanylidene-4-propan-2-yl-1,4-benzoxazin-6-yl]amino]-4-oxidanylidene-butanoate Openeye Name: 4-[[(2S)-4-isopropyl-2-methyl-3-oxo-1,4-benzoxazin-6-yl]amino]-4-oxo-butanoate CAS Name: 4-[[(2S)-2-methyl-3-oxo-4-propan-2-yl-1,4-benzoxazin-6-yl]amino]-4-oxobutanoate IUPAC Name: 4-[[(2S)-2-methyl-3-oxo-4-propan-2-yl-1,4-benzoxazin-6-yl]amino]-4-oxobutanoate Traditional Name: 4-[[(2S)-4-isopropyl-3-keto-2-methyl-1,4-benzoxazin-6-yl]amino]-4-keto-butyrate Formula: C16H19N2O5- MolecularWeight: 319.33246

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=C(O1)C=CC(=C2)NC(=O)CCC(=O)[O-])C(C)C

Isomeric SMILES

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

InChI

InChI=1S/C16H20N2O5/c1-9(2)18-12-8-11(17-14(19)6-7-15(20)21)4-5-13(12)23-10(3)16(18)22/h4-5,8-10H,6-7H2,1-3H3,(H,17,19)(H,20,21)/p-1/t10-/m0/s1