N-phenylaniline; 1,2,4-trimethylbenzene

Systemtic Name: N-phenylaniline; 1,2,4-trimethylbenzene Openeye Name: N-phenylaniline; 1,2,4-trimethylbenzene CAS Name: N-phenylaniline; 1,2,4-trimethylbenzene IUPAC Name: N-phenylaniline; 1,2,4-trimethylbenzene Traditional Name: diphenylamine; pseudocumene Formula: C21H23N MolecularWeight: 289.41402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C.C1=CC=C(C=C1)NC2=CC=CC=C2

Isomeric SMILES

CC1=CC(=C(C=C1)C)C.C1=CC=C(C=C1)NC2=CC=CC=C2

InChI

InChI=1S/C12H11N.C9H12/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;1-7-4-5-8(2)9(3)6-7/h1-10,13H;4-6H,1-3H3