propan-2-yl (2S)-2-[(2R)-7-azanyl-2-methyl-2,3-dihydro-1,4-benzoxazin-4-yl]butanoate

Systemtic Name: propan-2-yl (2S)-2-[(2R)-7-azanyl-2-methyl-2,3-dihydro-1,4-benzoxazin-4-yl]butanoate Openeye Name: isopropyl (2S)-2-[(2R)-7-amino-2-methyl-2,3-dihydro-1,4-benzoxazin-4-yl]butanoate CAS Name: (2S)-2-[(2R)-7-amino-2-methyl-2,3-dihydro-1,4-benzoxazin-4-yl]butanoic acid propan-2-yl ester IUPAC Name: propan-2-yl (2S)-2-[(2R)-7-amino-2-methyl-2,3-dihydro-1,4-benzoxazin-4-yl]butanoate Traditional Name: (2S)-2-[(2R)-7-amino-2-methyl-2,3-dihydro-1,4-benzoxazin-4-yl]butyric acid isopropyl ester Formula: C16H24N2O3 MolecularWeight: 292.37336

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OC(C)C)N1CC(OC2=C1C=CC(=C2)N)C

Isomeric SMILES

CC[C@@H](C(=O)OC(C)C)N1C[C@H](OC2=C1C=CC(=C2)N)C

InChI

InChI=1S/C16H24N2O3/c1-5-13(16(19)20-10(2)3)18-9-11(4)21-15-8-12(17)6-7-14(15)18/h6-8,10-11,13H,5,9,17H2,1-4H3/t11-,13+/m1/s1