1-[(3-chlorophenyl)methyl]-4-nitro-indole-2-carboxylic acid

Systemtic Name: 1-[(3-chlorophenyl)methyl]-4-nitro-indole-2-carboxylic acid Openeye Name: 1-[(3-chlorophenyl)methyl]-4-nitro-indole-2-carboxylic acid CAS Name: 1-[(3-chlorophenyl)methyl]-4-nitro-2-indolecarboxylic acid IUPAC Name: 1-[(3-chlorophenyl)methyl]-4-nitroindole-2-carboxylic acid Traditional Name: 1-(3-chlorobenzyl)-4-nitro-indole-2-carboxylic acid Formula: C16H11ClN2O4 MolecularWeight: 330.72254

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H11ClN2O4/c17-11-4-1-3-10(7-11)9-18-13-5-2-6-14(19(22)23)12(13)8-15(18)16(20)21/h1-8H,9H2,(H,20,21)