N4-(benzotriazol-1-ylmethyl)-N1-methyl-N1-[(2S)-octan-2-yl]-N4-phenyl-benzene-1,4-diamine

Systemtic Name: N4-(benzotriazol-1-ylmethyl)-N1-methyl-N1-[(2S)-octan-2-yl]-N4-phenyl-benzene-1,4-diamine Openeye Name: N4-(benzotriazol-1-ylmethyl)-N1-methyl-N1-[(1S)-1-methylheptyl]-N4-phenyl-benzene-1,4-diamine CAS Name: N4-(1-benzotriazolylmethyl)-N1-methyl-N1-[(2S)-octan-2-yl]-N4-phenylbenzene-1,4-diamine IUPAC Name: 4-N-(benzotriazol-1-ylmethyl)-1-N-methyl-1-N-[(2S)-octan-2-yl]-4-N-phenylbenzene-1,4-diamine Traditional Name: benzotriazol-1-ylmethyl-[4-[methyl-[(1S)-1-methylheptyl]amino]phenyl]-phenyl-amine Formula: C28H35N5 MolecularWeight: 441.611

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)N(C)C1=CC=C(C=C1)N(CN2C3=CC=CC=C3N=N2)C4=CC=CC=C4

Isomeric SMILES

CCCCCC[C@H](C)N(C)C1=CC=C(C=C1)N(CN2C3=CC=CC=C3N=N2)C4=CC=CC=C4

InChI

InChI=1S/C28H35N5/c1-4-5-6-8-13-23(2)31(3)24-18-20-26(21-19-24)32(25-14-9-7-10-15-25)22-33-28-17-12-11-16-27(28)29-30-33/h7,9-12,14-21,23H,4-6,8,13,22H2,1-3H3/t23-/m0/s1