2-phenoxyethyl 4-(methylamino)-3-nitro-benzoate

Systemtic Name: 2-phenoxyethyl 4-(methylamino)-3-nitro-benzoate Openeye Name: 2-phenoxyethyl 4-(methylamino)-3-nitro-benzoate CAS Name: 4-(methylamino)-3-nitrobenzoic acid 2-phenoxyethyl ester IUPAC Name: 2-phenoxyethyl 4-(methylamino)-3-nitrobenzoate Traditional Name: 4-(methylamino)-3-nitro-benzoic acid 2-phenoxyethyl ester Formula: C16H16N2O5 MolecularWeight: 316.30864

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)C(=O)OCCOC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1)C(=O)OCCOC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H16N2O5/c1-17-14-8-7-12(11-15(14)18(20)21)16(19)23-10-9-22-13-5-3-2-4-6-13/h2-8,11,17H,9-10H2,1H3