N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentyl-4-morpholin-4-yl-3-nitro-benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentyl-4-morpholin-4-yl-3-nitro-benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentyl-4-morpholino-3-nitro-benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentyl-4-(4-morpholinyl)-3-nitrobenzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentyl-4-morpholin-4-yl-3-nitrobenzamide Traditional Name: N-cyclopentyl-4-morpholino-3-nitro-N-piperonyl-benzamide Formula: C24H27N3O6 MolecularWeight: 453.48768

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N(CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC(=C(C=C4)N5CCOCC5)[N+](=O)[O-]

Isomeric SMILES

C1CCC(C1)N(CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC(=C(C=C4)N5CCOCC5)[N+](=O)[O-]

InChI

InChI=1S/C24H27N3O6/c28-24(18-6-7-20(21(14-18)27(29)30)25-9-11-31-12-10-25)26(19-3-1-2-4-19)15-17-5-8-22-23(13-17)33-16-32-22/h5-8,13-14,19H,1-4,9-12,15-16H2