3-(4-chlorophenyl)-1-(6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl)-1-(2-dimethylaminoethyl)urea

Systemtic Name: 3-(4-chlorophenyl)-1-(6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl)-1-(2-dimethylaminoethyl)urea Openeye Name: 3-(4-chlorophenyl)-1-(6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl)-1-(2-dimethylaminoethyl)urea CAS Name: 3-(4-chlorophenyl)-1-(6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl)-1-(2-dimethylaminoethyl)urea IUPAC Name: 3-(4-chlorophenyl)-1-(6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl)-1-(2-dimethylaminoethyl)urea Traditional Name: 3-(4-chlorophenyl)-1-(6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl)-1-(2-dimethylaminoethyl)urea Formula: C23H27ClN4O3 MolecularWeight: 442.93848

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)N(CCN(C)C)C(=O)NC3=CC=C(C=C3)Cl)O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)N(CCN(C)C)C(=O)NC3=CC=C(C=C3)Cl)O)C

InChI

InChI=1S/C23H27ClN4O3/c1-23(2)21(29)20(18-13-15(14-25)5-10-19(18)31-23)28(12-11-27(3)4)22(30)26-17-8-6-16(24)7-9-17/h5-10,13,20-21,29H,11-12H2,1-4H3,(H,26,30)