3-naphthalen-2-yl-3-(5-nitrobenzimidazol-1-yl)propanoic acid

Systemtic Name: 3-naphthalen-2-yl-3-(5-nitrobenzimidazol-1-yl)propanoic acid Openeye Name: 3-(2-naphthyl)-3-(5-nitrobenzimidazol-1-yl)propanoic acid CAS Name: 3-(2-naphthalenyl)-3-(5-nitro-1-benzimidazolyl)propanoic acid IUPAC Name: 3-naphthalen-2-yl-3-(5-nitrobenzimidazol-1-yl)propanoic acid Traditional Name: 3-(2-naphthyl)-3-(5-nitrobenzimidazol-1-yl)propionic acid Formula: C20H15N3O4 MolecularWeight: 361.3508

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)C(CC(=O)O)N3C=NC4=C3C=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)C(CC(=O)O)N3C=NC4=C3C=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H15N3O4/c24-20(25)11-19(15-6-5-13-3-1-2-4-14(13)9-15)22-12-21-17-10-16(23(26)27)7-8-18(17)22/h1-10,12,19H,11H2,(H,24,25)