6-[4-(2-azanylpropan-2-yl)phenyl]isoquinoline-5-carboxamide

Systemtic Name: 6-[4-(2-azanylpropan-2-yl)phenyl]isoquinoline-5-carboxamide Openeye Name: 6-[4-(1-amino-1-methyl-ethyl)phenyl]isoquinoline-5-carboxamide CAS Name: 6-[4-(2-aminopropan-2-yl)phenyl]-5-isoquinolinecarboxamide IUPAC Name: 6-[4-(2-aminopropan-2-yl)phenyl]isoquinoline-5-carboxamide Traditional Name: 6-[4-(1-amino-1-methyl-ethyl)phenyl]isoquinoline-5-carboxamide Formula: C19H19N3O MolecularWeight: 305.37366

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19N3O/c1-19(2,21)14-6-3-12(4-7-14)15-8-5-13-11-22-10-9-16(13)17(15)18(20)23/h3-11H,21H2,1-2H3,(H2,20,23)