6-chloranyl-3-nitro-2-[(4-propoxyphenyl)amino]benzoic acid

Systemtic Name: 6-chloranyl-3-nitro-2-[(4-propoxyphenyl)amino]benzoic acid Openeye Name: 6-chloro-3-nitro-2-(4-propoxyanilino)benzoic acid CAS Name: 6-chloro-3-nitro-2-(4-propoxyanilino)benzoic acid IUPAC Name: 6-chloro-3-nitro-2-(4-propoxyanilino)benzoic acid Traditional Name: 6-chloro-3-nitro-2-(4-propoxyanilino)benzoic acid Formula: C16H15ClN2O5 MolecularWeight: 350.7537

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)NC2=C(C=CC(=C2C(=O)O)Cl)[N+](=O)[O-]

Isomeric SMILES

CCCOC1=CC=C(C=C1)NC2=C(C=CC(=C2C(=O)O)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H15ClN2O5/c1-2-9-24-11-5-3-10(4-6-11)18-15-13(19(22)23)8-7-12(17)14(15)16(20)21/h3-8,18H,2,9H2,1H3,(H,20,21)