(E)-3-(1,3-benzoxazol-2-yl)-4-naphthalen-2-yl-but-3-enoic acid

Systemtic Name: (E)-3-(1,3-benzoxazol-2-yl)-4-naphthalen-2-yl-but-3-enoic acid Openeye Name: (E)-3-(1,3-benzoxazol-2-yl)-4-(2-naphthyl)but-3-enoic acid CAS Name: (E)-3-(1,3-benzoxazol-2-yl)-4-(2-naphthalenyl)-3-butenoic acid IUPAC Name: (E)-3-(1,3-benzoxazol-2-yl)-4-naphthalen-2-ylbut-3-enoic acid Traditional Name: (E)-3-(1,3-benzoxazol-2-yl)-4-(2-naphthyl)but-3-enoic acid Formula: C21H15NO3 MolecularWeight: 329.3487

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)C=C(CC(=O)O)C3=NC4=CC=CC=C4O3

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)/C=C(\CC(=O)O)/C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C21H15NO3/c23-20(24)13-17(21-22-18-7-3-4-8-19(18)25-21)12-14-9-10-15-5-1-2-6-16(15)11-14/h1-12H,13H2,(H,23,24)/b17-12+