2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethanone

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethanone Openeye Name: 1-(4-benzyl-1,4-diazepan-1-yl)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanone CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethanone IUPAC Name: 1-(4-benzyl-1,4-diazepan-1-yl)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanone Traditional Name: 1-(4-benzyl-1,4-diazepan-1-yl)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanone Formula: C22H26N2O3 MolecularWeight: 366.45344

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)CC2=CC3=C(C=C2)OCCO3)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN(C1)C(=O)CC2=CC3=C(C=C2)OCCO3)CC4=CC=CC=C4

InChI

InChI=1S/C22H26N2O3/c25-22(16-19-7-8-20-21(15-19)27-14-13-26-20)24-10-4-9-23(11-12-24)17-18-5-2-1-3-6-18/h1-3,5-8,15H,4,9-14,16-17H2