1-[[4-[7-(phenylmethyl)-1-benzofuran-2-yl]phenyl]methyl]azetidine-3-carboxylic acid

Systemtic Name: 1-[[4-[7-(phenylmethyl)-1-benzofuran-2-yl]phenyl]methyl]azetidine-3-carboxylic acid Openeye Name: 1-[[4-(7-benzylbenzofuran-2-yl)phenyl]methyl]azetidine-3-carboxylic acid CAS Name: 1-[[4-[7-(phenylmethyl)-2-benzofuranyl]phenyl]methyl]-3-azetidinecarboxylic acid IUPAC Name: 1-[[4-(7-benzyl-1-benzofuran-2-yl)phenyl]methyl]azetidine-3-carboxylic acid Traditional Name: 1-[4-(7-benzylbenzofuran-2-yl)benzyl]azetidine-3-carboxylic acid Formula: C26H23NO3 MolecularWeight: 397.46572

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN1CC2=CC=C(C=C2)C3=CC4=C(O3)C(=CC=C4)CC5=CC=CC=C5)C(=O)O

Isomeric SMILES

C1C(CN1CC2=CC=C(C=C2)C3=CC4=C(O3)C(=CC=C4)CC5=CC=CC=C5)C(=O)O

InChI

InChI=1S/C26H23NO3/c28-26(29)23-16-27(17-23)15-19-9-11-20(12-10-19)24-14-22-8-4-7-21(25(22)30-24)13-18-5-2-1-3-6-18/h1-12,14,23H,13,15-17H2,(H,28,29)