3-[[(cyanoamino)-[(4-phenylphenyl)amino]methylidene]amino]-5-methyl-hexanoic acid

Systemtic Name: 3-[[(cyanoamino)-[(4-phenylphenyl)amino]methylidene]amino]-5-methyl-hexanoic acid Openeye Name: 3-[[(cyanoamino)-(4-phenylanilino)methylene]amino]-5-methyl-hexanoic acid CAS Name: 3-[[(cyanoamino)-(4-phenylanilino)methylidene]amino]-5-methylhexanoic acid IUPAC Name: 3-[[(cyanoamino)-(4-phenylanilino)methylidene]amino]-5-methylhexanoic acid Traditional Name: 3-[[(cyanoamino)-(4-phenylanilino)methylene]amino]-5-methyl-hexanoic acid Formula: C21H24N4O2 MolecularWeight: 364.44086

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CC(=O)O)N=C(NC#N)NC1=CC=C(C=C1)C2=CC=CC=C2

Isomeric SMILES

CC(C)CC(CC(=O)O)N=C(NC#N)NC1=CC=C(C=C1)C2=CC=CC=C2

InChI

InChI=1S/C21H24N4O2/c1-15(2)12-19(13-20(26)27)25-21(23-14-22)24-18-10-8-17(9-11-18)16-6-4-3-5-7-16/h3-11,15,19H,12-13H2,1-2H3,(H,26,27)(H2,23,24,25)