1-(3-azanylpropyl)-3,3-dimethyl-2-benzofuran-1-carbonitrile

Systemtic Name: 1-(3-azanylpropyl)-3,3-dimethyl-2-benzofuran-1-carbonitrile Openeye Name: 1-(3-aminopropyl)-3,3-dimethyl-isobenzofuran-1-carbonitrile CAS Name: 1-(3-aminopropyl)-3,3-dimethyl-1-isobenzofurancarbonitrile IUPAC Name: 1-(3-aminopropyl)-3,3-dimethyl-2-benzofuran-1-carbonitrile Traditional Name: 1-(3-aminopropyl)-3,3-dimethyl-phthalan-1-carbonitrile Formula: C14H18N2O MolecularWeight: 230.30552

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2C(O1)(CCCN)C#N)C

Isomeric SMILES

CC1(C2=CC=CC=C2C(O1)(CCCN)C#N)C

InChI

InChI=1S/C14H18N2O/c1-13(2)11-6-3-4-7-12(11)14(10-16,17-13)8-5-9-15/h3-4,6-7H,5,8-9,15H2,1-2H3