3-(phenylsulfonyl)-7-(3-piperidin-1-ylpropoxy)-1,2,4,5-tetrahydro-3-benzazepine

Systemtic Name: 3-(phenylsulfonyl)-7-(3-piperidin-1-ylpropoxy)-1,2,4,5-tetrahydro-3-benzazepine Openeye Name: 3-(benzenesulfonyl)-7-[3-(1-piperidyl)propoxy]-1,2,4,5-tetrahydro-3-benzazepine CAS Name: 3-(benzenesulfonyl)-7-[3-(1-piperidinyl)propoxy]-1,2,4,5-tetrahydro-3-benzazepine IUPAC Name: 3-(benzenesulfonyl)-7-(3-piperidin-1-ylpropoxy)-1,2,4,5-tetrahydro-3-benzazepine Traditional Name: 3-besyl-7-(3-piperidinopropoxy)-1,2,4,5-tetrahydro-3-benzazepine Formula: C24H32N2O3S MolecularWeight: 428.58748

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCOC2=CC3=C(CCN(CC3)S(=O)(=O)C4=CC=CC=C4)C=C2

Isomeric SMILES

C1CCN(CC1)CCCOC2=CC3=C(CCN(CC3)S(=O)(=O)C4=CC=CC=C4)C=C2

InChI

InChI=1S/C24H32N2O3S/c27-30(28,24-8-3-1-4-9-24)26-17-12-21-10-11-23(20-22(21)13-18-26)29-19-7-16-25-14-5-2-6-15-25/h1,3-4,8-11,20H,2,5-7,12-19H2