2-chloranylprop-2-enyl 3-nitro-4-[(phenylmethyl)amino]benzoate

Systemtic Name: 2-chloranylprop-2-enyl 3-nitro-4-[(phenylmethyl)amino]benzoate Openeye Name: 2-chloroallyl 4-(benzylamino)-3-nitro-benzoate CAS Name: 3-nitro-4-[(phenylmethyl)amino]benzoic acid 2-chloroprop-2-enyl ester IUPAC Name: 2-chloroprop-2-enyl 4-(benzylamino)-3-nitrobenzoate Traditional Name: 4-(benzylamino)-3-nitro-benzoic acid 2-chloroallyl ester Formula: C17H15ClN2O4 MolecularWeight: 346.765

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Descriptors Computed from Structure

Canonical SMILES:

C=C(COC(=O)C1=CC(=C(C=C1)NCC2=CC=CC=C2)[N+](=O)[O-])Cl

Isomeric SMILES

C=C(COC(=O)C1=CC(=C(C=C1)NCC2=CC=CC=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H15ClN2O4/c1-12(18)11-24-17(21)14-7-8-15(16(9-14)20(22)23)19-10-13-5-3-2-4-6-13/h2-9,19H,1,10-11H2