4-[[(cyanoamino)-[(4-phenoxyphenyl)amino]methylidene]amino]-5-phenyl-pentanoic acid

Systemtic Name: 4-[[(cyanoamino)-[(4-phenoxyphenyl)amino]methylidene]amino]-5-phenyl-pentanoic acid Openeye Name: 4-[[(cyanoamino)-(4-phenoxyanilino)methylene]amino]-5-phenyl-pentanoic acid CAS Name: 4-[[(cyanoamino)-(4-phenoxyanilino)methylidene]amino]-5-phenylpentanoic acid IUPAC Name: 4-[[(cyanoamino)-(4-phenoxyanilino)methylidene]amino]-5-phenylpentanoic acid Traditional Name: 4-[[(cyanoamino)-(4-phenoxyanilino)methylene]amino]-5-phenyl-valeric acid Formula: C25H24N4O3 MolecularWeight: 428.48306

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CCC(=O)O)N=C(NC#N)NC2=CC=C(C=C2)OC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CC(CCC(=O)O)N=C(NC#N)NC2=CC=C(C=C2)OC3=CC=CC=C3

InChI

InChI=1S/C25H24N4O3/c26-18-27-25(29-21(13-16-24(30)31)17-19-7-3-1-4-8-19)28-20-11-14-23(15-12-20)32-22-9-5-2-6-10-22/h1-12,14-15,21H,13,16-17H2,(H,30,31)(H2,27,28,29)