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

Systemtic Name: methyl (2S,3S)-3-methyl-2-[(4-oxidanylidene-3,1-benzoxazin-2-yl)amino]pentanoate Openeye Name: methyl (2S,3S)-3-methyl-2-[(4-oxo-3,1-benzoxazin-2-yl)amino]pentanoate CAS Name: (2S,3S)-3-methyl-2-[(4-oxo-3,1-benzoxazin-2-yl)amino]pentanoic acid methyl ester IUPAC Name: methyl (2S,3S)-3-methyl-2-[(4-oxo-3,1-benzoxazin-2-yl)amino]pentanoate Traditional Name: (2S,3S)-2-[(4-keto-3,1-benzoxazin-2-yl)amino]-3-methyl-valeric acid methyl ester Formula: C15H18N2O4 MolecularWeight: 290.31442

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)NC1=NC2=CC=CC=C2C(=O)O1

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)OC)NC1=NC2=CC=CC=C2C(=O)O1

InChI

InChI=1S/C15H18N2O4/c1-4-9(2)12(14(19)20-3)17-15-16-11-8-6-5-7-10(11)13(18)21-15/h5-9,12H,4H2,1-3H3,(H,16,17)/t9-,12-/m0/s1