1-[2-[4-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]-2-oxidanylidene-ethyl]quinoxalin-2-one

Systemtic Name: 1-[2-[4-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]-2-oxidanylidene-ethyl]quinoxalin-2-one Openeye Name: 1-[2-[4-[2-(azepan-1-yl)-2-oxo-ethyl]piperazin-1-yl]-2-oxo-ethyl]quinoxalin-2-one CAS Name: 1-[2-[4-[2-(1-azepanyl)-2-oxoethyl]-1-piperazinyl]-2-oxoethyl]-2-quinoxalinone IUPAC Name: 1-[2-[4-[2-(azepan-1-yl)-2-oxoethyl]piperazin-1-yl]-2-oxoethyl]quinoxalin-2-one Traditional Name: 1-[2-[4-[2-(azepan-1-yl)-2-keto-ethyl]piperazino]-2-keto-ethyl]quinoxalin-2-one Formula: C22H29N5O3 MolecularWeight: 411.49736

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CN2CCN(CC2)C(=O)CN3C4=CC=CC=C4N=CC3=O

Isomeric SMILES

C1CCCN(CC1)C(=O)CN2CCN(CC2)C(=O)CN3C4=CC=CC=C4N=CC3=O

InChI

InChI=1S/C22H29N5O3/c28-20-15-23-18-7-3-4-8-19(18)27(20)17-22(30)26-13-11-24(12-14-26)16-21(29)25-9-5-1-2-6-10-25/h3-4,7-8,15H,1-2,5-6,9-14,16-17H2