3-[4-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]-N-phenyl-propanamide

Systemtic Name: 3-[4-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]-N-phenyl-propanamide Openeye Name: 3-[4-[2-(azepan-1-yl)-2-oxo-ethyl]piperazin-1-yl]-N-phenyl-propanamide CAS Name: 3-[4-[2-(1-azepanyl)-2-oxoethyl]-1-piperazinyl]-N-phenylpropanamide IUPAC Name: 3-[4-[2-(azepan-1-yl)-2-oxoethyl]piperazin-1-yl]-N-phenylpropanamide Traditional Name: 3-[4-[2-(azepan-1-yl)-2-keto-ethyl]piperazino]-N-phenyl-propionamide Formula: C21H32N4O2 MolecularWeight: 372.50438

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CN2CCN(CC2)CCC(=O)NC3=CC=CC=C3

Isomeric SMILES

C1CCCN(CC1)C(=O)CN2CCN(CC2)CCC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H32N4O2/c26-20(22-19-8-4-3-5-9-19)10-13-23-14-16-24(17-15-23)18-21(27)25-11-6-1-2-7-12-25/h3-5,8-9H,1-2,6-7,10-18H2,(H,22,26)