azepan-1-yl-[1-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]piperidin-4-yl]methanone

Systemtic Name: azepan-1-yl-[1-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]piperidin-4-yl]methanone Openeye Name: azepan-1-yl-[1-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-4-piperidyl]methanone CAS Name: 1-azepanyl-[1-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-4-piperidinyl]methanone IUPAC Name: azepan-1-yl-[1-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]piperidin-4-yl]methanone Traditional Name: azepan-1-yl-[1-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-4-piperidyl]methanone Formula: C21H29BrN2O3 MolecularWeight: 437.37056

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CCN(CC2)CC3=CC4=C(C=C3Br)OCCO4

Isomeric SMILES

C1CCCN(CC1)C(=O)C2CCN(CC2)CC3=CC4=C(C=C3Br)OCCO4

InChI

InChI=1S/C21H29BrN2O3/c22-18-14-20-19(26-11-12-27-20)13-17(18)15-23-9-5-16(6-10-23)21(25)24-7-3-1-2-4-8-24/h13-14,16H,1-12,15H2