4-[8-azanyl-1-(3-phenylmethoxyphenyl)imidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxylic acid

Systemtic Name: 4-[8-azanyl-1-(3-phenylmethoxyphenyl)imidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxylic acid Openeye Name: 4-[8-amino-1-(3-benzyloxyphenyl)imidazo[1,5-a]pyrazin-3-yl]cyclohexanecarboxylic acid CAS Name: 4-[8-amino-1-(3-phenylmethoxyphenyl)-3-imidazo[1,5-a]pyrazinyl]-1-cyclohexanecarboxylic acid IUPAC Name: 4-[8-amino-1-(3-phenylmethoxyphenyl)imidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxylic acid Traditional Name: 4-[8-amino-1-(3-benzoxyphenyl)imidazo[1,5-a]pyrazin-3-yl]cyclohexanecarboxylic acid Formula: C26H26N4O3 MolecularWeight: 442.50964

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C2=NC(=C3N2C=CN=C3N)C4=CC(=CC=C4)OCC5=CC=CC=C5)C(=O)O

Isomeric SMILES

C1CC(CCC1C2=NC(=C3N2C=CN=C3N)C4=CC(=CC=C4)OCC5=CC=CC=C5)C(=O)O

InChI

InChI=1S/C26H26N4O3/c27-24-23-22(20-7-4-8-21(15-20)33-16-17-5-2-1-3-6-17)29-25(30(23)14-13-28-24)18-9-11-19(12-10-18)26(31)32/h1-8,13-15,18-19H,9-12,16H2,(H2,27,28)(H,31,32)