1-[9-methoxy-7-(4-methylphenyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]propan-1-one

Systemtic Name: 1-[9-methoxy-7-(4-methylphenyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]propan-1-one Openeye Name: 1-[9-methoxy-7-(p-tolyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]propan-1-one CAS Name: 1-[9-methoxy-7-(4-methylphenyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-1-propanone IUPAC Name: 1-[9-methoxy-7-(4-methylphenyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]propan-1-one Traditional Name: 1-[9-methoxy-7-(p-tolyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]propan-1-one Formula: C20H23NO3 MolecularWeight: 325.40152

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCOC2=C(C1)C=C(C=C2OC)C3=CC=C(C=C3)C

Isomeric SMILES

CCC(=O)N1CCOC2=C(C1)C=C(C=C2OC)C3=CC=C(C=C3)C

InChI

InChI=1S/C20H23NO3/c1-4-19(22)21-9-10-24-20-17(13-21)11-16(12-18(20)23-3)15-7-5-14(2)6-8-15/h5-8,11-12H,4,9-10,13H2,1-3H3