2-[(2,4-dinitrophenyl)amino]-3-(1H-indol-2-yl)propanoic acid

Systemtic Name: 2-[(2,4-dinitrophenyl)amino]-3-(1H-indol-2-yl)propanoic acid Openeye Name: 2-(2,4-dinitroanilino)-3-(1H-indol-2-yl)propanoic acid CAS Name: 2-(2,4-dinitroanilino)-3-(1H-indol-2-yl)propanoic acid IUPAC Name: 2-(2,4-dinitroanilino)-3-(1H-indol-2-yl)propanoic acid Traditional Name: 2-(2,4-dinitroanilino)-3-(1H-indol-2-yl)propionic acid Formula: C17H14N4O6 MolecularWeight: 370.31626

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(N2)CC(C(=O)O)NC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=C(N2)CC(C(=O)O)NC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H14N4O6/c22-17(23)15(8-11-7-10-3-1-2-4-13(10)18-11)19-14-6-5-12(20(24)25)9-16(14)21(26)27/h1-7,9,15,18-19H,8H2,(H,22,23)