2-[(3-nitrophenyl)amino]-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-ethanamide

Systemtic Name: 2-[(3-nitrophenyl)amino]-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-ethanamide Openeye Name: 2-(3-nitroanilino)-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-acetamide CAS Name: 2-(3-nitroanilino)-N-(5-spiro[1,3-benzodioxole-2,1'-cyclohexane]yl)acetamide IUPAC Name: 2-(3-nitroanilino)-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-ylacetamide Traditional Name: 2-(3-nitroanilino)-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-acetamide Formula: C20H21N3O5 MolecularWeight: 383.39784

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(CC1)OC3=C(O2)C=C(C=C3)NC(=O)CNC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCC2(CC1)OC3=C(O2)C=C(C=C3)NC(=O)CNC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H21N3O5/c24-19(13-21-14-5-4-6-16(11-14)23(25)26)22-15-7-8-17-18(12-15)28-20(27-17)9-2-1-3-10-20/h4-8,11-12,21H,1-3,9-10,13H2,(H,22,24)