(phenylmethyl) 2-[(2-chlorophenyl)methylamino]-5-nitro-benzoate

Systemtic Name: (phenylmethyl) 2-[(2-chlorophenyl)methylamino]-5-nitro-benzoate Openeye Name: benzyl 2-[(2-chlorophenyl)methylamino]-5-nitro-benzoate CAS Name: 2-[(2-chlorophenyl)methylamino]-5-nitrobenzoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[(2-chlorophenyl)methylamino]-5-nitrobenzoate Traditional Name: 2-[(2-chlorobenzyl)amino]-5-nitro-benzoic acid benzyl ester Formula: C21H17ClN2O4 MolecularWeight: 396.82368

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NCC3=CC=CC=C3Cl

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NCC3=CC=CC=C3Cl

InChI

InChI=1S/C21H17ClN2O4/c22-19-9-5-4-8-16(19)13-23-20-11-10-17(24(26)27)12-18(20)21(25)28-14-15-6-2-1-3-7-15/h1-12,23H,13-14H2