2-[(4-methyl-2,6-dinitro-phenyl)amino]ethyl 2-chloranylbenzoate

Systemtic Name: 2-[(4-methyl-2,6-dinitro-phenyl)amino]ethyl 2-chloranylbenzoate Openeye Name: 2-(4-methyl-2,6-dinitro-anilino)ethyl 2-chlorobenzoate CAS Name: 2-chlorobenzoic acid 2-(4-methyl-2,6-dinitroanilino)ethyl ester IUPAC Name: 2-(4-methyl-2,6-dinitroanilino)ethyl 2-chlorobenzoate Traditional Name: 2-chlorobenzoic acid 2-(4-methyl-2,6-dinitro-anilino)ethyl ester Formula: C16H14ClN3O6 MolecularWeight: 379.75186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)[N+](=O)[O-])NCCOC(=O)C2=CC=CC=C2Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C(=C1)[N+](=O)[O-])NCCOC(=O)C2=CC=CC=C2Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H14ClN3O6/c1-10-8-13(19(22)23)15(14(9-10)20(24)25)18-6-7-26-16(21)11-4-2-3-5-12(11)17/h2-5,8-9,18H,6-7H2,1H3