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

Systemtic Name: 1-[(3,4-dichlorophenyl)methyl]-4-nitro-indole-2-carboxylic acid Openeye Name: 1-[(3,4-dichlorophenyl)methyl]-4-nitro-indole-2-carboxylic acid CAS Name: 1-[(3,4-dichlorophenyl)methyl]-4-nitro-2-indolecarboxylic acid IUPAC Name: 1-[(3,4-dichlorophenyl)methyl]-4-nitroindole-2-carboxylic acid Traditional Name: 1-(3,4-dichlorobenzyl)-4-nitro-indole-2-carboxylic acid Formula: C16H10Cl2N2O4 MolecularWeight: 365.1676

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C(N2CC3=CC(=C(C=C3)Cl)Cl)C(=O)O)C(=C1)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C=C(N2CC3=CC(=C(C=C3)Cl)Cl)C(=O)O)C(=C1)[N+](=O)[O-]

InChI

InChI=1S/C16H10Cl2N2O4/c17-11-5-4-9(6-12(11)18)8-19-13-2-1-3-14(20(23)24)10(13)7-15(19)16(21)22/h1-7H,8H2,(H,21,22)