[7-(2-oxidanyl-4-pyrazol-1-yl-butan-2-yl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(4-propan-2-yloxyphenyl)methanone

Systemtic Name: [7-(2-oxidanyl-4-pyrazol-1-yl-butan-2-yl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(4-propan-2-yloxyphenyl)methanone Openeye Name: [7-(1-hydroxy-1-methyl-3-pyrazol-1-yl-propyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(4-isopropoxyphenyl)methanone CAS Name: [7-[2-hydroxy-4-(1-pyrazolyl)butan-2-yl]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(4-propan-2-yloxyphenyl)methanone IUPAC Name: [7-(2-hydroxy-4-pyrazol-1-ylbutan-2-yl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(4-propan-2-yloxyphenyl)methanone Traditional Name: [7-(1-hydroxy-1-methyl-3-pyrazol-1-yl-propyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(4-isopropoxyphenyl)methanone Formula: C26H31N3O4 MolecularWeight: 449.54204

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C(=O)N2CCOC3=C(C2)C=C(C=C3)C(C)(CCN4C=CC=N4)O

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)C(=O)N2CCOC3=C(C2)C=C(C=C3)C(C)(CCN4C=CC=N4)O

InChI

InChI=1S/C26H31N3O4/c1-19(2)33-23-8-5-20(6-9-23)25(30)28-15-16-32-24-10-7-22(17-21(24)18-28)26(3,31)11-14-29-13-4-12-27-29/h4-10,12-13,17,19,31H,11,14-16,18H2,1-3H3