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

Systemtic Name: 2-methoxy-1-[9-methoxy-7-(4-methylsulfanylphenyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethanone Openeye Name: 2-methoxy-1-[9-methoxy-7-(4-methylsulfanylphenyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethanone CAS Name: 2-methoxy-1-[9-methoxy-7-[4-(methylthio)phenyl]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethanone IUPAC Name: 2-methoxy-1-[9-methoxy-7-(4-methylsulfanylphenyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethanone Traditional Name: 2-methoxy-1-[9-methoxy-7-[4-(methylthio)phenyl]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethanone Formula: C20H23NO4S MolecularWeight: 373.46592

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Descriptors Computed from Structure

Canonical SMILES:

COCC(=O)N1CCOC2=C(C1)C=C(C=C2OC)C3=CC=C(C=C3)SC

Isomeric SMILES

COCC(=O)N1CCOC2=C(C1)C=C(C=C2OC)C3=CC=C(C=C3)SC

InChI

InChI=1S/C20H23NO4S/c1-23-13-19(22)21-8-9-25-20-16(12-21)10-15(11-18(20)24-2)14-4-6-17(26-3)7-5-14/h4-7,10-11H,8-9,12-13H2,1-3H3