[(2R)-2-(4-methoxyphenyl)azepan-1-yl]-(4-pyrazol-1-ylphenyl)methanone

Systemtic Name: [(2R)-2-(4-methoxyphenyl)azepan-1-yl]-(4-pyrazol-1-ylphenyl)methanone Openeye Name: [(2R)-2-(4-methoxyphenyl)azepan-1-yl]-(4-pyrazol-1-ylphenyl)methanone CAS Name: [(2R)-2-(4-methoxyphenyl)-1-azepanyl]-[4-(1-pyrazolyl)phenyl]methanone IUPAC Name: [(2R)-2-(4-methoxyphenyl)azepan-1-yl]-(4-pyrazol-1-ylphenyl)methanone Traditional Name: [(2R)-2-(4-methoxyphenyl)azepan-1-yl]-(4-pyrazol-1-ylphenyl)methanone Formula: C23H25N3O2 MolecularWeight: 375.4635

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CCCCCN2C(=O)C3=CC=C(C=C3)N4C=CC=N4

Isomeric SMILES

COC1=CC=C(C=C1)[C@H]2CCCCCN2C(=O)C3=CC=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C23H25N3O2/c1-28-21-13-9-18(10-14-21)22-6-3-2-4-16-25(22)23(27)19-7-11-20(12-8-19)26-17-5-15-24-26/h5,7-15,17,22H,2-4,6,16H2,1H3/t22-/m1/s1