2-azanyl-4-(1,3-benzodioxol-4-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-azanyl-4-(1,3-benzodioxol-4-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-4-(1,3-benzodioxol-4-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-4-(1,3-benzodioxol-4-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-4-(1,3-benzodioxol-4-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-4-(1,3-benzodioxol-4-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C17H15N3O2 MolecularWeight: 293.3199

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(C(=N2)N)C#N)C3=C4C(=CC=C3)OCO4

Isomeric SMILES

C1CCC2=C(C1)C(=C(C(=N2)N)C#N)C3=C4C(=CC=C3)OCO4

InChI

InChI=1S/C17H15N3O2/c18-8-12-15(10-4-1-2-6-13(10)20-17(12)19)11-5-3-7-14-16(11)22-9-21-14/h3,5,7H,1-2,4,6,9H2,(H2,19,20)