naphthalen-1-ylmethyl 2-chloranyl-5-nitro-benzoate

Systemtic Name: naphthalen-1-ylmethyl 2-chloranyl-5-nitro-benzoate Openeye Name: 1-naphthylmethyl 2-chloro-5-nitro-benzoate CAS Name: 2-chloro-5-nitrobenzoic acid 1-naphthalenylmethyl ester IUPAC Name: naphthalen-1-ylmethyl 2-chloro-5-nitrobenzoate Traditional Name: 2-chloro-5-nitro-benzoic acid 1-naphthylmethyl ester Formula: C18H12ClNO4 MolecularWeight: 341.74518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2COC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2COC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H12ClNO4/c19-17-9-8-14(20(22)23)10-16(17)18(21)24-11-13-6-3-5-12-4-1-2-7-15(12)13/h1-10H,11H2