3-[[2-(3-butylisoquinolin-1-yl)oxyethyl-methyl-amino]methylamino]-2-ethyl-benzamide

Systemtic Name: 3-[[2-(3-butylisoquinolin-1-yl)oxyethyl-methyl-amino]methylamino]-2-ethyl-benzamide Openeye Name: 3-[[2-[(3-butyl-1-isoquinolyl)oxy]ethyl-methyl-amino]methylamino]-2-ethyl-benzamide CAS Name: 3-[[2-[(3-butyl-1-isoquinolinyl)oxy]ethyl-methylamino]methylamino]-2-ethylbenzamide IUPAC Name: 3-[[2-(3-butylisoquinolin-1-yl)oxyethyl-methylamino]methylamino]-2-ethylbenzamide Traditional Name: 3-[[2-[(3-butyl-1-isoquinolyl)oxy]ethyl-methyl-amino]methylamino]-2-ethyl-benzamide Formula: C26H34N4O2 MolecularWeight: 434.57376

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=CC=CC=C2C(=N1)OCCN(C)CNC3=CC=CC(=C3CC)C(=O)N

Isomeric SMILES

CCCCC1=CC2=CC=CC=C2C(=N1)OCCN(C)CNC3=CC=CC(=C3CC)C(=O)N

InChI

InChI=1S/C26H34N4O2/c1-4-6-11-20-17-19-10-7-8-12-22(19)26(29-20)32-16-15-30(3)18-28-24-14-9-13-23(25(27)31)21(24)5-2/h7-10,12-14,17,28H,4-6,11,15-16,18H2,1-3H3,(H2,27,31)