2-[(3-nitro-4-piperidin-1-yl-phenyl)methylidene]indene-1,3-dione

Systemtic Name: 2-[(3-nitro-4-piperidin-1-yl-phenyl)methylidene]indene-1,3-dione Openeye Name: 2-[[3-nitro-4-(1-piperidyl)phenyl]methylene]indane-1,3-dione CAS Name: 2-[[3-nitro-4-(1-piperidinyl)phenyl]methylidene]indene-1,3-dione IUPAC Name: 2-[(3-nitro-4-piperidin-1-ylphenyl)methylidene]indene-1,3-dione Traditional Name: 2-(3-nitro-4-piperidino-benzylidene)indane-1,3-quinone Formula: C21H18N2O4 MolecularWeight: 362.37862

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C=C3C(=O)C4=CC=CC=C4C3=O)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)C=C3C(=O)C4=CC=CC=C4C3=O)[N+](=O)[O-]

InChI

InChI=1S/C21H18N2O4/c24-20-15-6-2-3-7-16(15)21(25)17(20)12-14-8-9-18(19(13-14)23(26)27)22-10-4-1-5-11-22/h2-3,6-9,12-13H,1,4-5,10-11H2