2-(3,4,5,6-tetrahydro-2H-azepin-7-ylamino)-5-(trifluoromethyl)benzaldehyde

Systemtic Name: 2-(3,4,5,6-tetrahydro-2H-azepin-7-ylamino)-5-(trifluoromethyl)benzaldehyde Openeye Name: 2-(3,4,5,6-tetrahydro-2H-azepin-7-ylamino)-5-(trifluoromethyl)benzaldehyde CAS Name: 2-(3,4,5,6-tetrahydro-2H-azepin-7-ylamino)-5-(trifluoromethyl)benzaldehyde IUPAC Name: 2-(3,4,5,6-tetrahydro-2H-azepin-7-ylamino)-5-(trifluoromethyl)benzaldehyde Traditional Name: 2-(3,4,5,6-tetrahydro-2H-azepin-7-ylamino)-5-(trifluoromethyl)benzaldehyde Formula: C14H15F3N2O MolecularWeight: 284.27691

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=NCC1)NC2=C(C=C(C=C2)C(F)(F)F)C=O

Isomeric SMILES

C1CCC(=NCC1)NC2=C(C=C(C=C2)C(F)(F)F)C=O

InChI

InChI=1S/C14H15F3N2O/c15-14(16,17)11-5-6-12(10(8-11)9-20)19-13-4-2-1-3-7-18-13/h5-6,8-9H,1-4,7H2,(H,18,19)