6-[4-(2-azanylpropan-2-yl)phenyl]-4-bromanyl-2H-isoquinolin-1-one

Systemtic Name: 6-[4-(2-azanylpropan-2-yl)phenyl]-4-bromanyl-2H-isoquinolin-1-one Openeye Name: 6-[4-(1-amino-1-methyl-ethyl)phenyl]-4-bromo-2H-isoquinolin-1-one CAS Name: 6-[4-(2-aminopropan-2-yl)phenyl]-4-bromo-2H-isoquinolin-1-one IUPAC Name: 6-[4-(2-aminopropan-2-yl)phenyl]-4-bromo-2H-isoquinolin-1-one Traditional Name: 6-[4-(1-amino-1-methyl-ethyl)phenyl]-4-bromo-isocarbostyril Formula: C18H17BrN2O MolecularWeight: 357.24438

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=C(C=C1)C2=CC3=C(C=C2)C(=O)NC=C3Br)N

Isomeric SMILES

CC(C)(C1=CC=C(C=C1)C2=CC3=C(C=C2)C(=O)NC=C3Br)N

InChI

InChI=1S/C18H17BrN2O/c1-18(2,20)13-6-3-11(4-7-13)12-5-8-14-15(9-12)16(19)10-21-17(14)22/h3-10H,20H2,1-2H3,(H,21,22)