4-(but-3-enylamino)-N-isoquinolin-5-yl-cyclohexane-1-carboxamide dichloride

Systemtic Name: 4-(but-3-enylamino)-N-isoquinolin-5-yl-cyclohexane-1-carboxamide dichloride Openeye Name: 4-(but-3-enylamino)-N-(5-isoquinolyl)cyclohexanecarboxamide dichloride CAS Name: 4-(but-3-enylamino)-N-(5-isoquinolinyl)-1-cyclohexanecarboxamide dichloride IUPAC Name: 4-(but-3-enylamino)-N-isoquinolin-5-ylcyclohexane-1-carboxamide dichloride Traditional Name: 4-(but-3-enylamino)-N-(5-isoquinolyl)cyclohexanecarboxamide dichloride Formula: C20H25Cl2N3O-2 MolecularWeight: 394.338

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCNC1CCC(CC1)C(=O)NC2=CC=CC3=C2C=CN=C3.[Cl-].[Cl-]

Isomeric SMILES

C=CCCNC1CCC(CC1)C(=O)NC2=CC=CC3=C2C=CN=C3.[Cl-].[Cl-]

InChI

InChI=1S/C20H25N3O.2ClH/c1-2-3-12-22-17-9-7-15(8-10-17)20(24)23-19-6-4-5-16-14-21-13-11-18(16)19;;/h2,4-6,11,13-15,17,22H,1,3,7-10,12H2,(H,23,24);2*1H/p-2