4-(cyclopropylamino)-N-[(6-morpholin-4-ylpyridin-3-yl)methyl]-3-nitro-benzamide

Systemtic Name: 4-(cyclopropylamino)-N-[(6-morpholin-4-ylpyridin-3-yl)methyl]-3-nitro-benzamide Openeye Name: 4-(cyclopropylamino)-N-[(6-morpholino-3-pyridyl)methyl]-3-nitro-benzamide CAS Name: 4-(cyclopropylamino)-N-[[6-(4-morpholinyl)-3-pyridinyl]methyl]-3-nitrobenzamide IUPAC Name: 4-(cyclopropylamino)-N-[(6-morpholin-4-ylpyridin-3-yl)methyl]-3-nitrobenzamide Traditional Name: 4-(cyclopropylamino)-N-[(6-morpholino-3-pyridyl)methyl]-3-nitro-benzamide Formula: C20H23N5O4 MolecularWeight: 397.42772

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=C(C=C(C=C2)C(=O)NCC3=CN=C(C=C3)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

C1CC1NC2=C(C=C(C=C2)C(=O)NCC3=CN=C(C=C3)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C20H23N5O4/c26-20(15-2-5-17(23-16-3-4-16)18(11-15)25(27)28)22-13-14-1-6-19(21-12-14)24-7-9-29-10-8-24/h1-2,5-6,11-12,16,23H,3-4,7-10,13H2,(H,22,26)