(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-[4-(phenylmethyl)piperidin-1-yl]methanone

Systemtic Name: (6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-[4-(phenylmethyl)piperidin-1-yl]methanone Openeye Name: (4-benzyl-1-piperidyl)-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methanone CAS Name: (6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-[4-(phenylmethyl)-1-piperidinyl]methanone IUPAC Name: (4-benzylpiperidin-1-yl)-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methanone Traditional Name: (4-benzylpiperidino)-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methanone Formula: C22H24ClNO3 MolecularWeight: 385.88386

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=CC(=C2)C(=O)N3CCC(CC3)CC4=CC=CC=C4)Cl)OC1

Isomeric SMILES

C1COC2=C(C(=CC(=C2)C(=O)N3CCC(CC3)CC4=CC=CC=C4)Cl)OC1

InChI

InChI=1S/C22H24ClNO3/c23-19-14-18(15-20-21(19)27-12-4-11-26-20)22(25)24-9-7-17(8-10-24)13-16-5-2-1-3-6-16/h1-3,5-6,14-15,17H,4,7-13H2