methyl 5-nitro-7-phenylmethoxy-1H-indole-2-carboxylate

Systemtic Name: methyl 5-nitro-7-phenylmethoxy-1H-indole-2-carboxylate Openeye Name: methyl 7-benzyloxy-5-nitro-1H-indole-2-carboxylate CAS Name: 5-nitro-7-phenylmethoxy-1H-indole-2-carboxylic acid methyl ester IUPAC Name: methyl 5-nitro-7-phenylmethoxy-1H-indole-2-carboxylate Traditional Name: 7-benzoxy-5-nitro-1H-indole-2-carboxylic acid methyl ester Formula: C17H14N2O5 MolecularWeight: 326.30346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=CC(=CC(=C2N1)OCC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC2=CC(=CC(=C2N1)OCC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H14N2O5/c1-23-17(20)14-8-12-7-13(19(21)22)9-15(16(12)18-14)24-10-11-5-3-2-4-6-11/h2-9,18H,10H2,1H3