6-[2-(5-methyl-2-phenylmethoxy-phenyl)cyclopenten-1-yl]pyrazine-2-carboxylic acid

Systemtic Name: 6-[2-(5-methyl-2-phenylmethoxy-phenyl)cyclopenten-1-yl]pyrazine-2-carboxylic acid Openeye Name: 6-[2-(2-benzyloxy-5-methyl-phenyl)cyclopenten-1-yl]pyrazine-2-carboxylic acid CAS Name: 6-[2-(5-methyl-2-phenylmethoxyphenyl)-1-cyclopentenyl]-2-pyrazinecarboxylic acid IUPAC Name: 6-[2-(5-methyl-2-phenylmethoxyphenyl)cyclopenten-1-yl]pyrazine-2-carboxylic acid Traditional Name: 6-[2-(2-benzoxy-5-methyl-phenyl)cyclopenten-1-yl]pyrazinoic acid Formula: C24H22N2O3 MolecularWeight: 386.44308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC2=CC=CC=C2)C3=C(CCC3)C4=CN=CC(=N4)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)OCC2=CC=CC=C2)C3=C(CCC3)C4=CN=CC(=N4)C(=O)O

InChI

InChI=1S/C24H22N2O3/c1-16-10-11-23(29-15-17-6-3-2-4-7-17)20(12-16)18-8-5-9-19(18)21-13-25-14-22(26-21)24(27)28/h2-4,6-7,10-14H,5,8-9,15H2,1H3,(H,27,28)