2-methylpropyl 3,5-bis(azanyl)-4-nitro-benzoate

Systemtic Name: 2-methylpropyl 3,5-bis(azanyl)-4-nitro-benzoate Openeye Name: isobutyl 3,5-diamino-4-nitro-benzoate CAS Name: 3,5-diamino-4-nitrobenzoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 3,5-diamino-4-nitrobenzoate Traditional Name: 3,5-diamino-4-nitro-benzoic acid isobutyl ester Formula: C11H15N3O4 MolecularWeight: 253.2545

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C1=CC(=C(C(=C1)N)[N+](=O)[O-])N

Isomeric SMILES

CC(C)COC(=O)C1=CC(=C(C(=C1)N)[N+](=O)[O-])N

InChI

InChI=1S/C11H15N3O4/c1-6(2)5-18-11(15)7-3-8(12)10(14(16)17)9(13)4-7/h3-4,6H,5,12-13H2,1-2H3