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

Systemtic Name: 2-azanyl-4-(6-methyl-1,3-benzodioxol-5-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-4-(6-methyl-1,3-benzodioxol-5-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-4-(6-methyl-1,3-benzodioxol-5-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-4-(6-methyl-1,3-benzodioxol-5-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-4-(6-methyl-1,3-benzodioxol-5-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C18H17N3O2 MolecularWeight: 307.34648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C3=C(C(=NC4=C3CCCC4)N)C#N)OCO2

Isomeric SMILES

CC1=CC2=C(C=C1C3=C(C(=NC4=C3CCCC4)N)C#N)OCO2

InChI

InChI=1S/C18H17N3O2/c1-10-6-15-16(23-9-22-15)7-12(10)17-11-4-2-3-5-14(11)21-18(20)13(17)8-19/h6-7H,2-5,9H2,1H3,(H2,20,21)