3,5-bis(trifluoromethyl)benzaldehyde; (2-ethoxyphenyl)methanamine

Systemtic Name: 3,5-bis(trifluoromethyl)benzaldehyde; (2-ethoxyphenyl)methanamine Openeye Name: 3,5-bis(trifluoromethyl)benzaldehyde; (2-ethoxyphenyl)methanamine CAS Name: 3,5-bis(trifluoromethyl)benzaldehyde; (2-ethoxyphenyl)methanamine IUPAC Name: 3,5-bis(trifluoromethyl)benzaldehyde; (2-ethoxyphenyl)methanamine Traditional Name: 3,5-bis(trifluoromethyl)benzaldehyde; (2-ethoxybenzyl)amine Formula: C18H17F6NO2 MolecularWeight: 393.323499

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1CN.C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)C=O

Isomeric SMILES

CCOC1=CC=CC=C1CN.C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)C=O

InChI

InChI=1S/C9H4F6O.C9H13NO/c10-8(11,12)6-1-5(4-16)2-7(3-6)9(13,14)15;1-2-11-9-6-4-3-5-8(9)7-10/h1-4H;3-6H,2,7,10H2,1H3