5-azanyl-6-[4-(2-azanylpropan-2-yl)phenyl]-3,4-dihydro-2H-isoquinolin-1-one

Systemtic Name: 5-azanyl-6-[4-(2-azanylpropan-2-yl)phenyl]-3,4-dihydro-2H-isoquinolin-1-one Openeye Name: 5-amino-6-[4-(1-amino-1-methyl-ethyl)phenyl]-3,4-dihydro-2H-isoquinolin-1-one CAS Name: 5-amino-6-[4-(2-aminopropan-2-yl)phenyl]-3,4-dihydro-2H-isoquinolin-1-one IUPAC Name: 5-amino-6-[4-(2-aminopropan-2-yl)phenyl]-3,4-dihydro-2H-isoquinolin-1-one Traditional Name: 5-amino-6-[4-(1-amino-1-methyl-ethyl)phenyl]-3,4-dihydroisocarbostyril Formula: C18H21N3O MolecularWeight: 295.37884

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=C(C=C1)C2=C(C3=C(C=C2)C(=O)NCC3)N)N

Isomeric SMILES

CC(C)(C1=CC=C(C=C1)C2=C(C3=C(C=C2)C(=O)NCC3)N)N

InChI

InChI=1S/C18H21N3O/c1-18(2,20)12-5-3-11(4-6-12)13-7-8-15-14(16(13)19)9-10-21-17(15)22/h3-8H,9-10,19-20H2,1-2H3,(H,21,22)