2-[2-[(2-azanyl-3,7-dicyano-4,6-dimethyl-cyclopenta[b]pyridin-1-ium-5-ylidene)methyl]-6-methoxy-phenoxy]-N-phenyl-ethanamide

Systemtic Name: 2-[2-[(2-azanyl-3,7-dicyano-4,6-dimethyl-cyclopenta[b]pyridin-1-ium-5-ylidene)methyl]-6-methoxy-phenoxy]-N-phenyl-ethanamide Openeye Name: 2-[2-[(2-amino-3,7-dicyano-4,6-dimethyl-cyclopenta[b]pyridin-1-ium-5-ylidene)methyl]-6-methoxy-phenoxy]-N-phenyl-acetamide CAS Name: 2-[2-[(2-amino-3,7-dicyano-4,6-dimethyl-5-cyclopenta[b]pyridin-1-iumylidene)methyl]-6-methoxyphenoxy]-N-phenylacetamide IUPAC Name: 2-[2-[(2-amino-3,7-dicyano-4,6-dimethylcyclopenta[b]pyridin-1-ium-5-ylidene)methyl]-6-methoxyphenoxy]-N-phenylacetamide Traditional Name: 2-[2-[(2-amino-3,7-dicyano-4,6-dimethyl-1-pyrindin-1-ium-5-ylidene)methyl]-6-methoxy-phenoxy]-N-phenyl-acetamide Formula: C28H24N5O3+ MolecularWeight: 478.52186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C1=CC3=C(C(=CC=C3)OC)OCC(=O)NC4=CC=CC=C4)C(=C(C(=[NH+]2)N)C#N)C)C#N

Isomeric SMILES

CC1=C(C2=C(C1=CC3=C(C(=CC=C3)OC)OCC(=O)NC4=CC=CC=C4)C(=C(C(=[NH+]2)N)C#N)C)C#N

InChI

InChI=1S/C28H23N5O3/c1-16-20(25-17(2)22(14-30)28(31)33-26(25)21(16)13-29)12-18-8-7-11-23(35-3)27(18)36-15-24(34)32-19-9-5-4-6-10-19/h4-12H,15H2,1-3H3,(H2,31,33)(H,32,34)/p+1