2-azanyl-5-[2-(5-methyl-2-phenylmethoxy-phenyl)cyclopenten-1-yl]benzoic acid

Systemtic Name: 2-azanyl-5-[2-(5-methyl-2-phenylmethoxy-phenyl)cyclopenten-1-yl]benzoic acid Openeye Name: 2-amino-5-[2-(2-benzyloxy-5-methyl-phenyl)cyclopenten-1-yl]benzoic acid CAS Name: 2-amino-5-[2-(5-methyl-2-phenylmethoxyphenyl)-1-cyclopentenyl]benzoic acid IUPAC Name: 2-amino-5-[2-(5-methyl-2-phenylmethoxyphenyl)cyclopenten-1-yl]benzoic acid Traditional Name: 2-amino-5-[2-(2-benzoxy-5-methyl-phenyl)cyclopenten-1-yl]benzoic acid Formula: C26H25NO3 MolecularWeight: 399.4816

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H25NO3/c1-17-10-13-25(30-16-18-6-3-2-4-7-18)22(14-17)21-9-5-8-20(21)19-11-12-24(27)23(15-19)26(28)29/h2-4,6-7,10-15H,5,8-9,16,27H2,1H3,(H,28,29)