7-methoxy-2-methyl-3-[4-[2-oxidanyl-3-(propan-2-ylamino)propoxy]phenyl]isoquinolin-1-one

Systemtic Name: 7-methoxy-2-methyl-3-[4-[2-oxidanyl-3-(propan-2-ylamino)propoxy]phenyl]isoquinolin-1-one Openeye Name: 3-[4-[2-hydroxy-3-(isopropylamino)propoxy]phenyl]-7-methoxy-2-methyl-isoquinolin-1-one CAS Name: 3-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]-7-methoxy-2-methyl-1-isoquinolinone IUPAC Name: 3-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]-7-methoxy-2-methylisoquinolin-1-one Traditional Name: 3-[4-[2-hydroxy-3-(isopropylamino)propoxy]phenyl]-7-methoxy-2-methyl-isocarbostyril Formula: C23H28N2O4 MolecularWeight: 396.47942

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC(COC1=CC=C(C=C1)C2=CC3=C(C=C(C=C3)OC)C(=O)N2C)O

Isomeric SMILES

CC(C)NCC(COC1=CC=C(C=C1)C2=CC3=C(C=C(C=C3)OC)C(=O)N2C)O

InChI

InChI=1S/C23H28N2O4/c1-15(2)24-13-18(26)14-29-19-8-5-16(6-9-19)22-11-17-7-10-20(28-4)12-21(17)23(27)25(22)3/h5-12,15,18,24,26H,13-14H2,1-4H3