6-[[[(1R)-1-(4-methylphenyl)propyl]amino]methylidene]-4-nitro-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[[(1R)-1-(4-methylphenyl)propyl]amino]methylidene]-4-nitro-cyclohexa-2,4-dien-1-one Openeye Name: 4-nitro-6-[[[(1R)-1-(p-tolyl)propyl]amino]methylene]cyclohexa-2,4-dien-1-one CAS Name: 6-[[[(1R)-1-(4-methylphenyl)propyl]amino]methylidene]-4-nitro-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[[(1R)-1-(4-methylphenyl)propyl]amino]methylidene]-4-nitrocyclohexa-2,4-dien-1-one Traditional Name: 4-nitro-6-[[[(1R)-1-(p-tolyl)propyl]amino]methylene]cyclohexa-2,4-dien-1-one Formula: C17H18N2O3 MolecularWeight: 298.33642

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)C)NC=C2C=C(C=CC2=O)[N+](=O)[O-]

Isomeric SMILES

CC[C@H](C1=CC=C(C=C1)C)NC=C2C=C(C=CC2=O)[N+](=O)[O-]

InChI

InChI=1S/C17H18N2O3/c1-3-16(13-6-4-12(2)5-7-13)18-11-14-10-15(19(21)22)8-9-17(14)20/h4-11,16,18H,3H2,1-2H3/t16-/m1/s1