[4-(4-ethoxyphenyl)sulfonyl-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]-morpholin-4-yl-methanone

Systemtic Name: [4-(4-ethoxyphenyl)sulfonyl-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]-morpholin-4-yl-methanone Openeye Name: [4-(4-ethoxyphenyl)sulfonyl-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]-morpholino-methanone CAS Name: [4-(4-ethoxyphenyl)sulfonyl-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]-(4-morpholinyl)methanone IUPAC Name: [4-(4-ethoxyphenyl)sulfonyl-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]-morpholin-4-ylmethanone Traditional Name: morpholino-(4-p-phenetylsulfonyl-3,5-dihydro-2H-1,4-benzoxazepin-7-yl)methanone Formula: C22H26N2O6S MolecularWeight: 446.51664

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCOC3=C(C2)C=C(C=C3)C(=O)N4CCOCC4

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCOC3=C(C2)C=C(C=C3)C(=O)N4CCOCC4

InChI

InChI=1S/C22H26N2O6S/c1-2-29-19-4-6-20(7-5-19)31(26,27)24-11-14-30-21-8-3-17(15-18(21)16-24)22(25)23-9-12-28-13-10-23/h3-8,15H,2,9-14,16H2,1H3