naphthalen-1-ylmethyl 3-nitrobenzoate

Systemtic Name: naphthalen-1-ylmethyl 3-nitrobenzoate Openeye Name: 1-naphthylmethyl 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid 1-naphthalenylmethyl ester IUPAC Name: naphthalen-1-ylmethyl 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid 1-naphthylmethyl ester Formula: C18H13NO4 MolecularWeight: 307.30012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H13NO4/c20-18(14-7-4-9-16(11-14)19(21)22)23-12-15-8-3-6-13-5-1-2-10-17(13)15/h1-11H,12H2