(6E)-6-[2-(cyclohexylamino)-6-methyl-5-nitro-1H-pyrimidin-4-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-6-[2-(cyclohexylamino)-6-methyl-5-nitro-1H-pyrimidin-4-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6E)-6-[2-(cyclohexylamino)-6-methyl-5-nitro-1H-pyrimidin-4-ylidene]cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-[2-(cyclohexylamino)-6-methyl-5-nitro-1H-pyrimidin-4-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-6-[2-(cyclohexylamino)-6-methyl-5-nitro-1H-pyrimidin-4-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: (6E)-6-[2-(cyclohexylamino)-6-methyl-5-nitro-1H-pyrimidin-4-ylidene]cyclohexa-2,4-dien-1-one Formula: C17H20N4O3 MolecularWeight: 328.3657

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2C=CC=CC2=O)N=C(N1)NC3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(/C(=C\2/C=CC=CC2=O)/N=C(N1)NC3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C17H20N4O3/c1-11-16(21(23)24)15(13-9-5-6-10-14(13)22)20-17(18-11)19-12-7-3-2-4-8-12/h5-6,9-10,12H,2-4,7-8H2,1H3,(H2,18,19,20)/b15-13+