[9-methoxy-7-(3-methoxyphenyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(1H-pyrazol-4-yl)methanone

Systemtic Name: [9-methoxy-7-(3-methoxyphenyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(1H-pyrazol-4-yl)methanone Openeye Name: [9-methoxy-7-(3-methoxyphenyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(1H-pyrazol-4-yl)methanone CAS Name: [9-methoxy-7-(3-methoxyphenyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(1H-pyrazol-4-yl)methanone IUPAC Name: [9-methoxy-7-(3-methoxyphenyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(1H-pyrazol-4-yl)methanone Traditional Name: [9-methoxy-7-(3-methoxyphenyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(1H-pyrazol-4-yl)methanone Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=CC3=C(C(=C2)OC)OCCN(C3)C(=O)C4=CNN=C4

Isomeric SMILES

COC1=CC=CC(=C1)C2=CC3=C(C(=C2)OC)OCCN(C3)C(=O)C4=CNN=C4

InChI

InChI=1S/C21H21N3O4/c1-26-18-5-3-4-14(9-18)15-8-16-13-24(21(25)17-11-22-23-12-17)6-7-28-20(16)19(10-15)27-2/h3-5,8-12H,6-7,13H2,1-2H3,(H,22,23)