7-(butylamino)-3-(trifluoromethyl)benzo[7]annulene-7-carbonitrile

Systemtic Name: 7-(butylamino)-3-(trifluoromethyl)benzo[7]annulene-7-carbonitrile Openeye Name: 7-(butylamino)-3-(trifluoromethyl)benzo[7]annulene-7-carbonitrile CAS Name: 7-(butylamino)-3-(trifluoromethyl)-7-benzo[7]annulenecarbonitrile IUPAC Name: 7-(butylamino)-3-(trifluoromethyl)benzo[7]annulene-7-carbonitrile Traditional Name: 7-(butylamino)-3-(trifluoromethyl)benzocycloheptene-7-carbonitrile Formula: C17H17F3N2 MolecularWeight: 306.32549

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1(C=CC2=C(C=C1)C=C(C=C2)C(F)(F)F)C#N

Isomeric SMILES

CCCCNC1(C=CC2=C(C=C1)C=C(C=C2)C(F)(F)F)C#N

InChI

InChI=1S/C17H17F3N2/c1-2-3-10-22-16(12-21)8-6-13-4-5-15(17(18,19)20)11-14(13)7-9-16/h4-9,11,22H,2-3,10H2,1H3