4-[1,2,3-benzotriazin-4-yl-(4-dimethylaminophenyl)methyl]-3-chloranyl-N,N-diethyl-aniline

Systemtic Name: 4-[1,2,3-benzotriazin-4-yl-(4-dimethylaminophenyl)methyl]-3-chloranyl-N,N-diethyl-aniline Openeye Name: 4-[1,2,3-benzotriazin-4-yl-(4-dimethylaminophenyl)methyl]-3-chloro-N,N-diethyl-aniline CAS Name: 4-[1,2,3-benzotriazin-4-yl-(4-dimethylaminophenyl)methyl]-3-chloro-N,N-diethylaniline IUPAC Name: 4-[1,2,3-benzotriazin-4-yl-(4-dimethylaminophenyl)methyl]-3-chloro-N,N-diethylaniline Traditional Name: [4-[1,2,3-benzotriazin-4-yl-[2-chloro-4-(diethylamino)phenyl]methyl]phenyl]-dimethyl-amine Formula: C26H28ClN5 MolecularWeight: 445.98702

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=C(C=C1)C(C2=CC=C(C=C2)N(C)C)C3=NN=NC4=CC=CC=C43)Cl

Isomeric SMILES

CCN(CC)C1=CC(=C(C=C1)C(C2=CC=C(C=C2)N(C)C)C3=NN=NC4=CC=CC=C43)Cl

InChI

InChI=1S/C26H28ClN5/c1-5-32(6-2)20-15-16-21(23(27)17-20)25(18-11-13-19(14-12-18)31(3)4)26-22-9-7-8-10-24(22)28-30-29-26/h7-17,25H,5-6H2,1-4H3