4-(cyclopropylamino)-N-[(2R)-4-methyl-2-morpholin-4-yl-pentyl]-3-nitro-benzamide

Systemtic Name: 4-(cyclopropylamino)-N-[(2R)-4-methyl-2-morpholin-4-yl-pentyl]-3-nitro-benzamide Openeye Name: 4-(cyclopropylamino)-N-[(2R)-4-methyl-2-morpholino-pentyl]-3-nitro-benzamide CAS Name: 4-(cyclopropylamino)-N-[(2R)-4-methyl-2-(4-morpholinyl)pentyl]-3-nitrobenzamide IUPAC Name: 4-(cyclopropylamino)-N-[(2R)-4-methyl-2-morpholin-4-ylpentyl]-3-nitrobenzamide Traditional Name: 4-(cyclopropylamino)-N-[(2R)-4-methyl-2-morpholino-pentyl]-3-nitro-benzamide Formula: C20H30N4O4 MolecularWeight: 390.4766

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CNC(=O)C1=CC(=C(C=C1)NC2CC2)[N+](=O)[O-])N3CCOCC3

Isomeric SMILES

CC(C)C[C@H](CNC(=O)C1=CC(=C(C=C1)NC2CC2)[N+](=O)[O-])N3CCOCC3

InChI

InChI=1S/C20H30N4O4/c1-14(2)11-17(23-7-9-28-10-8-23)13-21-20(25)15-3-6-18(22-16-4-5-16)19(12-15)24(26)27/h3,6,12,14,16-17,22H,4-5,7-11,13H2,1-2H3,(H,21,25)/t17-/m1/s1