(2-chloranyl-5-nitro-phenyl)methyl 4-methylbenzoate

Systemtic Name: (2-chloranyl-5-nitro-phenyl)methyl 4-methylbenzoate Openeye Name: (2-chloro-5-nitro-phenyl)methyl 4-methylbenzoate CAS Name: 4-methylbenzoic acid (2-chloro-5-nitrophenyl)methyl ester IUPAC Name: (2-chloro-5-nitrophenyl)methyl 4-methylbenzoate Traditional Name: 4-methylbenzoic acid (2-chloro-5-nitro-benzyl) ester Formula: C15H12ClNO4 MolecularWeight: 305.71308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OCC2=C(C=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OCC2=C(C=CC(=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C15H12ClNO4/c1-10-2-4-11(5-3-10)15(18)21-9-12-8-13(17(19)20)6-7-14(12)16/h2-8H,9H2,1H3