methyl 2-[4-[(6-nitro-2H-1,4-benzoxazin-3-yl)amino]phenyl]ethanoate

Systemtic Name: methyl 2-[4-[(6-nitro-2H-1,4-benzoxazin-3-yl)amino]phenyl]ethanoate Openeye Name: methyl 2-[4-[(6-nitro-2H-1,4-benzoxazin-3-yl)amino]phenyl]acetate CAS Name: 2-[4-[(6-nitro-2H-1,4-benzoxazin-3-yl)amino]phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-[(6-nitro-2H-1,4-benzoxazin-3-yl)amino]phenyl]acetate Traditional Name: 2-[4-[(6-nitro-2H-1,4-benzoxazin-3-yl)amino]phenyl]acetic acid methyl ester Formula: C17H15N3O5 MolecularWeight: 341.3181

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC=C(C=C1)NC2=NC3=C(C=CC(=C3)[N+](=O)[O-])OC2

Isomeric SMILES

COC(=O)CC1=CC=C(C=C1)NC2=NC3=C(C=CC(=C3)[N+](=O)[O-])OC2

InChI

InChI=1S/C17H15N3O5/c1-24-17(21)8-11-2-4-12(5-3-11)18-16-10-25-15-7-6-13(20(22)23)9-14(15)19-16/h2-7,9H,8,10H2,1H3,(H,18,19)