(2S,5R)-2-chloranyl-8-(4-methylphenyl)-3,4,8-triazaspiro[4.4]non-3-ene-7,9-dione

Systemtic Name: (2S,5R)-2-chloranyl-8-(4-methylphenyl)-3,4,8-triazaspiro[4.4]non-3-ene-7,9-dione Openeye Name: (2S,5R)-2-chloro-8-(p-tolyl)-3,4,8-triazaspiro[4.4]non-3-ene-7,9-dione CAS Name: (2S,5R)-2-chloro-8-(4-methylphenyl)-3,4,8-triazaspiro[4.4]non-3-ene-7,9-dione IUPAC Name: (2S,5R)-2-chloro-8-(4-methylphenyl)-3,4,8-triazaspiro[4.4]non-3-ene-7,9-dione Traditional Name: (2S,5R)-2-chloro-8-(p-tolyl)-3,4,8-triazaspiro[4.4]non-3-ene-7,9-quinone Formula: C13H12ClN3O2 MolecularWeight: 277.70628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)CC3(C2=O)CC(N=N3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C[C@]3(C2=O)C[C@@H](N=N3)Cl

InChI

InChI=1S/C13H12ClN3O2/c1-8-2-4-9(5-3-8)17-11(18)7-13(12(17)19)6-10(14)15-16-13/h2-5,10H,6-7H2,1H3/t10-,13+/m1/s1