2-azanyl-3-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-5,6,7,8-tetrahydroindolizine-1-carbonitrile

Systemtic Name: 2-azanyl-3-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-5,6,7,8-tetrahydroindolizine-1-carbonitrile Openeye Name: 2-amino-3-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-5,6,7,8-tetrahydroindolizine-1-carbonitrile CAS Name: 2-amino-3-[2,3-dihydro-1,4-benzodioxin-6-yl(oxo)methyl]-5,6,7,8-tetrahydroindolizine-1-carbonitrile IUPAC Name: 2-amino-3-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-5,6,7,8-tetrahydroindolizine-1-carbonitrile Traditional Name: 2-amino-3-(2,3-dihydro-1,4-benzodioxin-6-carbonyl)-5,6,7,8-tetrahydroindolizine-1-carbonitrile Formula: C18H17N3O3 MolecularWeight: 323.34588

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN2C(=C(C(=C2C(=O)C3=CC4=C(C=C3)OCCO4)N)C#N)C1

Isomeric SMILES

C1CCN2C(=C(C(=C2C(=O)C3=CC4=C(C=C3)OCCO4)N)C#N)C1

InChI

InChI=1S/C18H17N3O3/c19-10-12-13-3-1-2-6-21(13)17(16(12)20)18(22)11-4-5-14-15(9-11)24-8-7-23-14/h4-5,9H,1-3,6-8,20H2