(6E)-6-[[(4-butan-2-ylphenyl)amino]methylidene]-4-chloranyl-2-nitro-cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-6-[[(4-butan-2-ylphenyl)amino]methylidene]-4-chloranyl-2-nitro-cyclohexa-2,4-dien-1-one Openeye Name: (6E)-4-chloro-2-nitro-6-[(4-sec-butylanilino)methylene]cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-[(4-butan-2-ylanilino)methylidene]-4-chloro-2-nitro-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-6-[(4-butan-2-ylanilino)methylidene]-4-chloro-2-nitrocyclohexa-2,4-dien-1-one Traditional Name: (6E)-4-chloro-2-nitro-6-[(4-sec-butylanilino)methylene]cyclohexa-2,4-dien-1-one Formula: C17H17ClN2O3 MolecularWeight: 332.78148

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC=C2C=C(C=C(C2=O)[N+](=O)[O-])Cl

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)N/C=C/2\C=C(C=C(C2=O)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H17ClN2O3/c1-3-11(2)12-4-6-15(7-5-12)19-10-13-8-14(18)9-16(17(13)21)20(22)23/h4-11,19H,3H2,1-2H3/b13-10+