4-(cyclopropylamino)-3-nitro-N-[[2-(piperidin-1-ylmethyl)phenyl]methyl]benzamide

Systemtic Name: 4-(cyclopropylamino)-3-nitro-N-[[2-(piperidin-1-ylmethyl)phenyl]methyl]benzamide Openeye Name: 4-(cyclopropylamino)-3-nitro-N-[[2-(1-piperidylmethyl)phenyl]methyl]benzamide CAS Name: 4-(cyclopropylamino)-3-nitro-N-[[2-(1-piperidinylmethyl)phenyl]methyl]benzamide IUPAC Name: 4-(cyclopropylamino)-3-nitro-N-[[2-(piperidin-1-ylmethyl)phenyl]methyl]benzamide Traditional Name: 4-(cyclopropylamino)-3-nitro-N-[2-(piperidinomethyl)benzyl]benzamide Formula: C23H28N4O3 MolecularWeight: 408.49342

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC=CC=C2CNC(=O)C3=CC(=C(C=C3)NC4CC4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)CC2=CC=CC=C2CNC(=O)C3=CC(=C(C=C3)NC4CC4)[N+](=O)[O-]

InChI

InChI=1S/C23H28N4O3/c28-23(17-8-11-21(25-20-9-10-20)22(14-17)27(29)30)24-15-18-6-2-3-7-19(18)16-26-12-4-1-5-13-26/h2-3,6-8,11,14,20,25H,1,4-5,9-10,12-13,15-16H2,(H,24,28)