1-[(4-methoxyphenyl)methyl]-5-nitro-indole-2-carboxylic acid

Systemtic Name: 1-[(4-methoxyphenyl)methyl]-5-nitro-indole-2-carboxylic acid Openeye Name: 1-[(4-methoxyphenyl)methyl]-5-nitro-indole-2-carboxylic acid CAS Name: 1-[(4-methoxyphenyl)methyl]-5-nitro-2-indolecarboxylic acid IUPAC Name: 1-[(4-methoxyphenyl)methyl]-5-nitroindole-2-carboxylic acid Traditional Name: 5-nitro-1-p-anisyl-indole-2-carboxylic acid Formula: C17H14N2O5 MolecularWeight: 326.30346

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C3=C(C=C(C=C3)[N+](=O)[O-])C=C2C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)CN2C3=C(C=C(C=C3)[N+](=O)[O-])C=C2C(=O)O

InChI

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