4-chloranyl-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(3-methylpiperidin-1-yl)sulfonyl-benzamide

Systemtic Name: 4-chloranyl-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(3-methylpiperidin-1-yl)sulfonyl-benzamide Openeye Name: 4-chloro-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-[(3-methyl-1-piperidyl)sulfonyl]benzamide CAS Name: 4-chloro-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-[(3-methyl-1-piperidinyl)sulfonyl]benzamide IUPAC Name: 4-chloro-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(3-methylpiperidin-1-yl)sulfonylbenzamide Traditional Name: 4-chloro-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(3-methylpiperidino)sulfonyl-benzamide Formula: C22H25ClN2O5S MolecularWeight: 464.9623

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CC4=C(C=C3)OCCCO4)Cl

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CC4=C(C=C3)OCCCO4)Cl

InChI

InChI=1S/C22H25ClN2O5S/c1-15-4-2-9-25(14-15)31(27,28)21-12-16(5-7-18(21)23)22(26)24-17-6-8-19-20(13-17)30-11-3-10-29-19/h5-8,12-13,15H,2-4,9-11,14H2,1H3,(H,24,26)