N-(6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl)-3-phenylmethoxy-propanamide

Systemtic Name: N-(6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl)-3-phenylmethoxy-propanamide Openeye Name: 3-benzyloxy-N-(6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl)propanamide CAS Name: N-(6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl)-3-phenylmethoxypropanamide IUPAC Name: N-(6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl)-3-phenylmethoxypropanamide Traditional Name: 3-benzoxy-N-(6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl)propionamide Formula: C22H24N2O4 MolecularWeight: 380.43696

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)NC(=O)CCOCC3=CC=CC=C3)O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)NC(=O)CCOCC3=CC=CC=C3)O)C

InChI

InChI=1S/C22H24N2O4/c1-22(2)21(26)20(17-12-16(13-23)8-9-18(17)28-22)24-19(25)10-11-27-14-15-6-4-3-5-7-15/h3-9,12,20-21,26H,10-11,14H2,1-2H3,(H,24,25)