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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)O)NC3=C(C(=CC=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)C[C@@H](C(=O)O)NC3=C(C(=CC=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H14N4O6/c22-17(23)14(8-10-9-18-12-5-2-1-4-11(10)12)19-13-6-3-7-15(20(24)25)16(13)21(26)27/h1-7,9,14,18-19H,8H2,(H,22,23)/t14-/m0/s1