6-[[[(2R)-2-(2-chlorophenyl)-2-pyrrolidin-1-yl-ethyl]amino]methylidene]-4-nitro-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[[(2R)-2-(2-chlorophenyl)-2-pyrrolidin-1-yl-ethyl]amino]methylidene]-4-nitro-cyclohexa-2,4-dien-1-one Openeye Name: 6-[[[(2R)-2-(2-chlorophenyl)-2-pyrrolidin-1-yl-ethyl]amino]methylene]-4-nitro-cyclohexa-2,4-dien-1-one CAS Name: 6-[[[(2R)-2-(2-chlorophenyl)-2-(1-pyrrolidinyl)ethyl]amino]methylidene]-4-nitro-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[[(2R)-2-(2-chlorophenyl)-2-pyrrolidin-1-ylethyl]amino]methylidene]-4-nitrocyclohexa-2,4-dien-1-one Traditional Name: 6-[[[(2R)-2-(2-chlorophenyl)-2-pyrrolidino-ethyl]amino]methylene]-4-nitro-cyclohexa-2,4-dien-1-one Formula: C19H20ClN3O3 MolecularWeight: 373.8334

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(CNC=C2C=C(C=CC2=O)[N+](=O)[O-])C3=CC=CC=C3Cl

Isomeric SMILES

C1CCN(C1)[C@@H](CNC=C2C=C(C=CC2=O)[N+](=O)[O-])C3=CC=CC=C3Cl

InChI

InChI=1S/C19H20ClN3O3/c20-17-6-2-1-5-16(17)18(22-9-3-4-10-22)13-21-12-14-11-15(23(25)26)7-8-19(14)24/h1-2,5-8,11-12,18,21H,3-4,9-10,13H2/t18-/m0/s1