(4-propan-2-ylphenyl) 4-[(2-chlorophenyl)methylamino]-3-nitro-benzoate

Systemtic Name: (4-propan-2-ylphenyl) 4-[(2-chlorophenyl)methylamino]-3-nitro-benzoate Openeye Name: (4-isopropylphenyl) 4-[(2-chlorophenyl)methylamino]-3-nitro-benzoate CAS Name: 4-[(2-chlorophenyl)methylamino]-3-nitrobenzoic acid (4-propan-2-ylphenyl) ester IUPAC Name: (4-propan-2-ylphenyl) 4-[(2-chlorophenyl)methylamino]-3-nitrobenzoate Traditional Name: 4-[(2-chlorobenzyl)amino]-3-nitro-benzoic acid p-cumenyl ester Formula: C23H21ClN2O4 MolecularWeight: 424.87684

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H21ClN2O4/c1-15(2)16-7-10-19(11-8-16)30-23(27)17-9-12-21(22(13-17)26(28)29)25-14-18-5-3-4-6-20(18)24/h3-13,15,25H,14H2,1-2H3