2-(1,3-benzodioxol-5-yl)-1-[9-methoxy-7-(5-methylthiophen-2-yl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethanone

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-1-[9-methoxy-7-(5-methylthiophen-2-yl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethanone Openeye Name: 2-(1,3-benzodioxol-5-yl)-1-[9-methoxy-7-(5-methyl-2-thienyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethanone CAS Name: 2-(1,3-benzodioxol-5-yl)-1-[9-methoxy-7-(5-methyl-2-thiophenyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethanone IUPAC Name: 2-(1,3-benzodioxol-5-yl)-1-[9-methoxy-7-(5-methylthiophen-2-yl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethanone Traditional Name: 2-(1,3-benzodioxol-5-yl)-1-[9-methoxy-7-(5-methyl-2-thienyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethanone Formula: C24H23NO5S MolecularWeight: 437.50812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C2=CC3=C(C(=C2)OC)OCCN(C3)C(=O)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC=C(S1)C2=CC3=C(C(=C2)OC)OCCN(C3)C(=O)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C24H23NO5S/c1-15-3-6-22(31-15)17-11-18-13-25(7-8-28-24(18)21(12-17)27-2)23(26)10-16-4-5-19-20(9-16)30-14-29-19/h3-6,9,11-12H,7-8,10,13-14H2,1-2H3