1-(3,4-dimethylphenyl)-4-(2-isocyanoethyl)piperazine

Systemtic Name: 1-(3,4-dimethylphenyl)-4-(2-isocyanoethyl)piperazine Openeye Name: 1-(3,4-dimethylphenyl)-4-(2-isocyanoethyl)piperazine CAS Name: 1-(3,4-dimethylphenyl)-4-(2-isocyanoethyl)piperazine IUPAC Name: 1-(3,4-dimethylphenyl)-4-(2-isocyanoethyl)piperazine Traditional Name: 1-(3,4-dimethylphenyl)-4-(2-isocyanoethyl)piperazine Formula: C15H21N3 MolecularWeight: 243.34734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2CCN(CC2)CC[N+]#[C-])C

Isomeric SMILES

CC1=C(C=C(C=C1)N2CCN(CC2)CC[N+]#[C-])C

InChI

InChI=1S/C15H21N3/c1-13-4-5-15(12-14(13)2)18-10-8-17(9-11-18)7-6-16-3/h4-5,12H,6-11H2,1-2H3