1-(3-azanyl-1-piperidin-4-yl-azepan-2-yl)-2-(4-chlorophenyl)ethanone

Systemtic Name: 1-(3-azanyl-1-piperidin-4-yl-azepan-2-yl)-2-(4-chlorophenyl)ethanone Openeye Name: 1-[3-amino-1-(4-piperidyl)azepan-2-yl]-2-(4-chlorophenyl)ethanone CAS Name: 1-[3-amino-1-(4-piperidinyl)-2-azepanyl]-2-(4-chlorophenyl)ethanone IUPAC Name: 1-(3-amino-1-piperidin-4-ylazepan-2-yl)-2-(4-chlorophenyl)ethanone Traditional Name: 1-[3-amino-1-(4-piperidyl)azepan-2-yl]-2-(4-chlorophenyl)ethanone Formula: C19H28ClN3O MolecularWeight: 349.89812

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C(C1)N)C(=O)CC2=CC=C(C=C2)Cl)C3CCNCC3

Isomeric SMILES

C1CCN(C(C(C1)N)C(=O)CC2=CC=C(C=C2)Cl)C3CCNCC3

InChI

InChI=1S/C19H28ClN3O/c20-15-6-4-14(5-7-15)13-18(24)19-17(21)3-1-2-12-23(19)16-8-10-22-11-9-16/h4-7,16-17,19,22H,1-3,8-13,21H2