N-(1-chloroethyl)-3-methyl-aniline; 2-[(3-methylphenyl)amino]propanenitrile

Systemtic Name: N-(1-chloroethyl)-3-methyl-aniline; 2-[(3-methylphenyl)amino]propanenitrile Openeye Name: N-(1-chloroethyl)-3-methyl-aniline; 2-(3-methylanilino)propanenitrile CAS Name: N-(1-chloroethyl)-3-methylaniline; 2-(3-methylanilino)propanenitrile IUPAC Name: N-(1-chloroethyl)-3-methylaniline; 2-(3-methylanilino)propanenitrile Traditional Name: 1-chloroethyl(m-tolyl)amine; 2-(m-toluidino)propionitrile Formula: C19H24ClN3 MolecularWeight: 329.86696

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(C)C#N.CC1=CC(=CC=C1)NC(C)Cl

Isomeric SMILES

CC1=CC(=CC=C1)NC(C)C#N.CC1=CC(=CC=C1)NC(C)Cl

InChI

InChI=1S/C10H12N2.C9H12ClN/c1-8-4-3-5-10(6-8)12-9(2)7-11;1-7-4-3-5-9(6-7)11-8(2)10/h3-6,9,12H,1-2H3;3-6,8,11H,1-2H3