4-(cyclopropylcarbonylamino)-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]benzamide

Systemtic Name: 4-(cyclopropylcarbonylamino)-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]benzamide Openeye Name: 4-(cyclopropanecarbonylamino)-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]benzamide CAS Name: 4-[[cyclopropyl(oxo)methyl]amino]-N-[[6-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]benzamide IUPAC Name: 4-(cyclopropanecarbonylamino)-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]benzamide Traditional Name: 4-(cyclopropanecarbonylamino)-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]benzamide Formula: C21H25N4O3+ MolecularWeight: 381.4482

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)NC2=CC=C(C=C2)C(=O)NCC3=C[NH+]=C(C=C3)N4CCOCC4

Isomeric SMILES

C1CC1C(=O)NC2=CC=C(C=C2)C(=O)NCC3=C[NH+]=C(C=C3)N4CCOCC4

InChI

InChI=1S/C21H24N4O3/c26-20(16-4-6-18(7-5-16)24-21(27)17-2-3-17)23-14-15-1-8-19(22-13-15)25-9-11-28-12-10-25/h1,4-8,13,17H,2-3,9-12,14H2,(H,23,26)(H,24,27)/p+1