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3-(aminomethyl)-4-butoxy-6-ethanoyl-2-(2-methylpropyl)isoquinolin-1-one

3-(aminomethyl)-4-butoxy-6-ethanoyl-2-(2-methylpropyl)isoquinolin-1-one

Systemtic Name:3-(aminomethyl)-4-butoxy-6-ethanoyl-2-(2-methylpropyl)isoquinolin-1-one
Openeye Name:6-acetyl-3-(aminomethyl)-4-butoxy-2-isobutyl-isoquinolin-1-one
CAS Name:6-acetyl-3-(aminomethyl)-4-butoxy-2-(2-methylpropyl)-1-isoquinolinone
IUPAC Name:6-acetyl-3-(aminomethyl)-4-butoxy-2-(2-methylpropyl)isoquinolin-1-one
Traditional Name:6-acetyl-3-(aminomethyl)-4-butoxy-2-isobutyl-isocarbostyril
Formula: C20H28N2O3
MolecularWeight: 344.44792
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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(N(C(=O)C2=C1C=C(C=C2)C(=O)C)CC(C)C)CN


Isomeric SMILES

CCCCOC1=C(N(C(=O)C2=C1C=C(C=C2)C(=O)C)CC(C)C)CN


InChI

InChI=1S/C20H28N2O3/c1-5-6-9-25-19-17-10-15(14(4)23)7-8-16(17)20(24)22(12-13(2)3)18(19)11-21/h7-8,10,13H,5-6,9,11-12,21H2,1-4H3


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