1-ethyl-3-(2-oxidanylpropylamino)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile

Systemtic Name: 1-ethyl-3-(2-oxidanylpropylamino)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Openeye Name: 1-ethyl-3-(2-hydroxypropylamino)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile CAS Name: 1-ethyl-3-(2-hydroxypropylamino)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile IUPAC Name: 1-ethyl-3-(2-hydroxypropylamino)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Traditional Name: 1-ethyl-3-(2-hydroxypropylamino)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Formula: C15H21N3O MolecularWeight: 259.34674

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2CCCCC2=C(C(=N1)NCC(C)O)C#N

Isomeric SMILES

CCC1=C2CCCCC2=C(C(=N1)NCC(C)O)C#N

InChI

InChI=1S/C15H21N3O/c1-3-14-12-7-5-4-6-11(12)13(8-16)15(18-14)17-9-10(2)19/h10,19H,3-7,9H2,1-2H3,(H,17,18)