propan-2-yl 4-(methylamino)-3-nitro-benzoate

Systemtic Name: propan-2-yl 4-(methylamino)-3-nitro-benzoate Openeye Name: isopropyl 4-(methylamino)-3-nitro-benzoate CAS Name: 4-(methylamino)-3-nitrobenzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-(methylamino)-3-nitrobenzoate Traditional Name: 4-(methylamino)-3-nitro-benzoic acid isopropyl ester Formula: C11H14N2O4 MolecularWeight: 238.23986

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14N2O4/c1-7(2)17-11(14)8-4-5-9(12-3)10(6-8)13(15)16/h4-7,12H,1-3H3