4-[3-(1,2-diazepin-1-yl)prop-2-ynyl]-1,4-dihydro-3,1-benzoxazin-2-one

Systemtic Name: 4-[3-(1,2-diazepin-1-yl)prop-2-ynyl]-1,4-dihydro-3,1-benzoxazin-2-one Openeye Name: 4-[3-(diazepin-1-yl)prop-2-ynyl]-1,4-dihydro-3,1-benzoxazin-2-one CAS Name: 4-[3-(1-diazepinyl)prop-2-ynyl]-1,4-dihydro-3,1-benzoxazin-2-one IUPAC Name: 4-[3-(diazepin-1-yl)prop-2-ynyl]-1,4-dihydro-3,1-benzoxazin-2-one Traditional Name: 4-[3-(diazepin-1-yl)prop-2-ynyl]-1,4-dihydro-3,1-benzoxazin-2-one Formula: C16H13N3O2 MolecularWeight: 279.29332

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NN(C=C1)C#CCC2C3=CC=CC=C3NC(=O)O2

Isomeric SMILES

C1=CC=NN(C=C1)C#CCC2C3=CC=CC=C3NC(=O)O2

InChI

InChI=1S/C16H13N3O2/c20-16-18-14-8-3-2-7-13(14)15(21-16)9-6-12-19-11-5-1-4-10-17-19/h1-5,7-8,10-11,15H,9H2,(H,18,20)