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2-[3-(1,2-diazepin-1-yl)prop-2-ynyl]-3H-isoindol-1-one

2-[3-(1,2-diazepin-1-yl)prop-2-ynyl]-3H-isoindol-1-one

Systemtic Name:2-[3-(1,2-diazepin-1-yl)prop-2-ynyl]-3H-isoindol-1-one
Openeye Name:2-[3-(diazepin-1-yl)prop-2-ynyl]isoindolin-1-one
CAS Name:2-[3-(1-diazepinyl)prop-2-ynyl]-3H-isoindol-1-one
IUPAC Name:2-[3-(diazepin-1-yl)prop-2-ynyl]-3H-isoindol-1-one
Traditional Name:2-[3-(diazepin-1-yl)prop-2-ynyl]isoindolin-1-one
Formula: C16H13N3O
MolecularWeight: 263.29392
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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=O)N1CC#CN3C=CC=CC=N3


Isomeric SMILES

C1C2=CC=CC=C2C(=O)N1CC#CN3C=CC=CC=N3


InChI

InChI=1S/C16H13N3O/c20-16-15-8-3-2-7-14(15)13-18(16)10-6-12-19-11-5-1-4-9-17-19/h1-5,7-9,11H,10,13H2


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