11-[(E)-5-piperidin-1-ylpent-2-enyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one

Systemtic Name: 11-[(E)-5-piperidin-1-ylpent-2-enyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one Openeye Name: 11-[(E)-5-(1-piperidyl)pent-2-enyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one CAS Name: 11-[(E)-5-(1-piperidinyl)pent-2-enyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one IUPAC Name: 11-[(E)-5-piperidin-1-ylpent-2-enyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one Traditional Name: 11-[(E)-5-piperidinopent-2-enyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one Formula: C22H26N4O MolecularWeight: 362.46804

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCC=CCN2C3=CC=CC=C3C(=O)NC4=C2N=CC=C4

Isomeric SMILES

C1CCN(CC1)CC/C=C/CN2C3=CC=CC=C3C(=O)NC4=C2N=CC=C4

InChI

InChI=1S/C22H26N4O/c27-22-18-10-3-4-12-20(18)26(21-19(24-22)11-9-13-23-21)17-8-2-7-16-25-14-5-1-6-15-25/h2-4,8-13H,1,5-7,14-17H2,(H,24,27)/b8-2+