methyl 2-[2-azanyl-3-(4-nitrophenyl)propanoyl]oxysulfonylbenzoate

Systemtic Name: methyl 2-[2-azanyl-3-(4-nitrophenyl)propanoyl]oxysulfonylbenzoate Openeye Name: methyl 2-[2-amino-3-(4-nitrophenyl)propanoyl]oxysulfonylbenzoate CAS Name: 2-[2-amino-3-(4-nitrophenyl)-1-oxopropoxy]sulfonylbenzoic acid methyl ester IUPAC Name: methyl 2-[2-amino-3-(4-nitrophenyl)propanoyl]oxysulfonylbenzoate Traditional Name: 2-[2-amino-3-(4-nitrophenyl)propanoyl]oxysulfonylbenzoic acid methyl ester Formula: C17H16N2O8S MolecularWeight: 408.38254

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1S(=O)(=O)OC(=O)C(CC2=CC=C(C=C2)[N+](=O)[O-])N

Isomeric SMILES

COC(=O)C1=CC=CC=C1S(=O)(=O)OC(=O)C(CC2=CC=C(C=C2)[N+](=O)[O-])N

InChI

InChI=1S/C17H16N2O8S/c1-26-16(20)13-4-2-3-5-15(13)28(24,25)27-17(21)14(18)10-11-6-8-12(9-7-11)19(22)23/h2-9,14H,10,18H2,1H3