2-[(2S)-2-[(1S)-1-cyclohexyl-2-nitro-ethyl]-3,4-dihydro-2H-naphthalen-1-ylidene]propanedinitrile

Systemtic Name: 2-[(2S)-2-[(1S)-1-cyclohexyl-2-nitro-ethyl]-3,4-dihydro-2H-naphthalen-1-ylidene]propanedinitrile Openeye Name: 2-[(2S)-2-[(1S)-1-cyclohexyl-2-nitro-ethyl]tetralin-1-ylidene]propanedinitrile CAS Name: 2-[(2S)-2-[(1S)-1-cyclohexyl-2-nitroethyl]-3,4-dihydro-2H-naphthalen-1-ylidene]propanedinitrile IUPAC Name: 2-[(2S)-2-[(1S)-1-cyclohexyl-2-nitroethyl]-3,4-dihydro-2H-naphthalen-1-ylidene]propanedinitrile Traditional Name: 2-[(2S)-2-[(1S)-1-cyclohexyl-2-nitro-ethyl]tetralin-1-ylidene]malononitrile Formula: C21H23N3O2 MolecularWeight: 349.42622

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(C[N+](=O)[O-])C2CCC3=CC=CC=C3C2=C(C#N)C#N

Isomeric SMILES

C1CCC(CC1)[C@H](C[N+](=O)[O-])[C@@H]2CCC3=CC=CC=C3C2=C(C#N)C#N

InChI

InChI=1S/C21H23N3O2/c22-12-17(13-23)21-18-9-5-4-8-16(18)10-11-19(21)20(14-24(25)26)15-6-2-1-3-7-15/h4-5,8-9,15,19-20H,1-3,6-7,10-11,14H2/t19-,20-/m0/s1