1-[7-(3-chlorophenyl)-9-(thiophen-3-ylmethoxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-2-methyl-propan-1-one

Systemtic Name: 1-[7-(3-chlorophenyl)-9-(thiophen-3-ylmethoxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-2-methyl-propan-1-one Openeye Name: 1-[7-(3-chlorophenyl)-9-(3-thienylmethoxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-2-methyl-propan-1-one CAS Name: 1-[7-(3-chlorophenyl)-9-(3-thiophenylmethoxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-2-methyl-1-propanone IUPAC Name: 1-[7-(3-chlorophenyl)-9-(thiophen-3-ylmethoxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-2-methylpropan-1-one Traditional Name: 1-[7-(3-chlorophenyl)-9-(3-thenyloxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-2-methyl-propan-1-one Formula: C24H24ClNO3S MolecularWeight: 441.97026

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCOC2=C(C1)C=C(C=C2OCC3=CSC=C3)C4=CC(=CC=C4)Cl

Isomeric SMILES

CC(C)C(=O)N1CCOC2=C(C1)C=C(C=C2OCC3=CSC=C3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C24H24ClNO3S/c1-16(2)24(27)26-7-8-28-23-20(13-26)10-19(18-4-3-5-21(25)11-18)12-22(23)29-14-17-6-9-30-15-17/h3-6,9-12,15-16H,7-8,13-14H2,1-2H3