1-[4-(2-isoquinolin-7-yloxyethoxy)-3-methyl-2-oxidanyl-phenyl]-3-methyl-butan-1-one

Systemtic Name: 1-[4-(2-isoquinolin-7-yloxyethoxy)-3-methyl-2-oxidanyl-phenyl]-3-methyl-butan-1-one Openeye Name: 1-[2-hydroxy-4-[2-(7-isoquinolyloxy)ethoxy]-3-methyl-phenyl]-3-methyl-butan-1-one CAS Name: 1-[2-hydroxy-4-[2-(7-isoquinolinyloxy)ethoxy]-3-methylphenyl]-3-methyl-1-butanone IUPAC Name: 1-[2-hydroxy-4-(2-isoquinolin-7-yloxyethoxy)-3-methylphenyl]-3-methylbutan-1-one Traditional Name: 1-[2-hydroxy-4-[2-(7-isoquinolyloxy)ethoxy]-3-methyl-phenyl]-3-methyl-butan-1-one Formula: C23H25NO4 MolecularWeight: 379.4489

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1O)C(=O)CC(C)C)OCCOC2=CC3=C(C=C2)C=CN=C3

Isomeric SMILES

CC1=C(C=CC(=C1O)C(=O)CC(C)C)OCCOC2=CC3=C(C=C2)C=CN=C3

InChI

InChI=1S/C23H25NO4/c1-15(2)12-21(25)20-6-7-22(16(3)23(20)26)28-11-10-27-19-5-4-17-8-9-24-14-18(17)13-19/h4-9,13-15,26H,10-12H2,1-3H3