2-[3-(dimethylamino)propyl]-1-oxidanylidene-isoquinoline-4-carbonitrile

Systemtic Name: 2-[3-(dimethylamino)propyl]-1-oxidanylidene-isoquinoline-4-carbonitrile Openeye Name: 2-[3-(dimethylamino)propyl]-1-oxo-isoquinoline-4-carbonitrile CAS Name: 2-[3-(dimethylamino)propyl]-1-oxo-4-isoquinolinecarbonitrile IUPAC Name: 2-[3-(dimethylamino)propyl]-1-oxoisoquinoline-4-carbonitrile Traditional Name: 2-[3-(dimethylamino)propyl]-1-keto-isoquinoline-4-carbonitrile Formula: C15H17N3O MolecularWeight: 255.31498

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCN1C=C(C2=CC=CC=C2C1=O)C#N

Isomeric SMILES

CN(C)CCCN1C=C(C2=CC=CC=C2C1=O)C#N

InChI

InChI=1S/C15H17N3O/c1-17(2)8-5-9-18-11-12(10-16)13-6-3-4-7-14(13)15(18)19/h3-4,6-7,11H,5,8-9H2,1-2H3