N-[2-[(6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl)-phenyl-amino]ethyl]ethanamide

Systemtic Name: N-[2-[(6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl)-phenyl-amino]ethyl]ethanamide Openeye Name: N-[2-(N-(6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl)anilino)ethyl]acetamide CAS Name: N-[2-(N-(6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl)anilino)ethyl]acetamide IUPAC Name: N-[2-(N-(6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl)anilino)ethyl]acetamide Traditional Name: N-[2-(N-(6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl)anilino)ethyl]acetamide Formula: C22H25N3O3 MolecularWeight: 379.4522

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCN(C1C(C(OC2=C1C=C(C=C2)C#N)(C)C)O)C3=CC=CC=C3

Isomeric SMILES

CC(=O)NCCN(C1C(C(OC2=C1C=C(C=C2)C#N)(C)C)O)C3=CC=CC=C3

InChI

InChI=1S/C22H25N3O3/c1-15(26)24-11-12-25(17-7-5-4-6-8-17)20-18-13-16(14-23)9-10-19(18)28-22(2,3)21(20)27/h4-10,13,20-21,27H,11-12H2,1-3H3,(H,24,26)