2-methyl-4-(2,3,4,5,6-pentadeuteriophenyl)aniline

Systemtic Name: 2-methyl-4-(2,3,4,5,6-pentadeuteriophenyl)aniline Openeye Name: 2-methyl-4-(2,3,4,5,6-pentadeuteriophenyl)aniline CAS Name: 2-methyl-4-(2,3,4,5,6-pentadeuteriophenyl)aniline IUPAC Name: 2-methyl-4-(2,3,4,5,6-pentadeuteriophenyl)aniline Traditional Name: [2-methyl-4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]amine Formula: C13H13N MolecularWeight: 188.279829

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=CC=CC=C2)N

Isomeric SMILES

[2H]C1=C(C(=C(C(=C1[2H])[2H])C2=CC(=C(C=C2)N)C)[2H])[2H]

InChI

InChI=1S/C13H13N/c1-10-9-12(7-8-13(10)14)11-5-3-2-4-6-11/h2-9H,14H2,1H3/i2D,3D,4D,5D,6D