4-[[2-(4-chlorophenyl)-1,3,3-triisocyano-prop-2-enylidene]amino]-N,N-diethyl-3-methyl-aniline

Systemtic Name: 4-[[2-(4-chlorophenyl)-1,3,3-triisocyano-prop-2-enylidene]amino]-N,N-diethyl-3-methyl-aniline Openeye Name: 2-(4-chlorophenyl)-N-[4-(diethylamino)-2-methyl-phenyl]-3,3-diisocyano-prop-2-enimidoyl isocyanide CAS Name: 4-[[2-(4-chlorophenyl)-1,3,3-triisocyanoprop-2-enylidene]amino]-N,N-diethyl-3-methylaniline IUPAC Name: 2-(4-chlorophenyl)-N-[4-(diethylamino)-2-methylphenyl]-3,3-diisocyanoprop-2-enimidoyl isocyanide Traditional Name: [4-[[2-(4-chlorophenyl)-1,3,3-triisocyano-prop-2-enylidene]amino]-3-methyl-phenyl]-diethyl-amine Formula: C23H20ClN5 MolecularWeight: 401.8914

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=C(C=C1)N=C(C(=C([N+]#[C-])[N+]#[C-])C2=CC=C(C=C2)Cl)[N+]#[C-])C

Isomeric SMILES

CCN(CC)C1=CC(=C(C=C1)N=C(C(=C([N+]#[C-])[N+]#[C-])C2=CC=C(C=C2)Cl)[N+]#[C-])C

InChI

InChI=1S/C23H20ClN5/c1-7-29(8-2)19-13-14-20(16(3)15-19)28-23(27-6)21(22(25-4)26-5)17-9-11-18(24)12-10-17/h9-15H,7-8H2,1-3H3