2-(butylamino)-2-(3-hexyl-3H-inden-1-yl)ethanenitrile

Systemtic Name: 2-(butylamino)-2-(3-hexyl-3H-inden-1-yl)ethanenitrile Openeye Name: 2-(butylamino)-2-(3-hexyl-3H-inden-1-yl)acetonitrile CAS Name: 2-(butylamino)-2-(3-hexyl-3H-inden-1-yl)acetonitrile IUPAC Name: 2-(butylamino)-2-(3-hexyl-3H-inden-1-yl)acetonitrile Traditional Name: 2-(butylamino)-2-(3-hexyl-3H-inden-1-yl)acetonitrile Formula: C21H30N2 MolecularWeight: 310.4763

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1C=C(C2=CC=CC=C12)C(C#N)NCCCC

Isomeric SMILES

CCCCCCC1C=C(C2=CC=CC=C12)C(C#N)NCCCC

InChI

InChI=1S/C21H30N2/c1-3-5-7-8-11-17-15-20(19-13-10-9-12-18(17)19)21(16-22)23-14-6-4-2/h9-10,12-13,15,17,21,23H,3-8,11,14H2,1-2H3