11-(6-piperidin-1-ylhex-2-ynyl)-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one

Systemtic Name: 11-(6-piperidin-1-ylhex-2-ynyl)-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one Openeye Name: 11-[6-(1-piperidyl)hex-2-ynyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one CAS Name: 11-[6-(1-piperidinyl)hex-2-ynyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one IUPAC Name: 11-(6-piperidin-1-ylhex-2-ynyl)-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one Traditional Name: 11-(6-piperidinohex-2-ynyl)-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one Formula: C23H26N4O MolecularWeight: 374.47874

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H26N4O/c28-23-19-11-4-5-13-21(19)27(22-20(25-23)12-10-14-24-22)18-9-2-1-6-15-26-16-7-3-8-17-26/h4-5,10-14H,1,3,6-8,15-18H2,(H,25,28)