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

Systemtic Name: 4-(cyclopropylamino)-3-nitro-N-[3-(piperidin-1-ylmethyl)phenyl]benzamide Openeye Name: 4-(cyclopropylamino)-3-nitro-N-[3-(1-piperidylmethyl)phenyl]benzamide CAS Name: 4-(cyclopropylamino)-3-nitro-N-[3-(1-piperidinylmethyl)phenyl]benzamide IUPAC Name: 4-(cyclopropylamino)-3-nitro-N-[3-(piperidin-1-ylmethyl)phenyl]benzamide Traditional Name: 4-(cyclopropylamino)-3-nitro-N-[3-(piperidinomethyl)phenyl]benzamide Formula: C22H26N4O3 MolecularWeight: 394.46684

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC(=CC=C2)NC(=O)C3=CC(=C(C=C3)NC4CC4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)CC2=CC(=CC=C2)NC(=O)C3=CC(=C(C=C3)NC4CC4)[N+](=O)[O-]

InChI

InChI=1S/C22H26N4O3/c27-22(17-7-10-20(23-18-8-9-18)21(14-17)26(28)29)24-19-6-4-5-16(13-19)15-25-11-2-1-3-12-25/h4-7,10,13-14,18,23H,1-3,8-9,11-12,15H2,(H,24,27)