1-(3,5-dimethyl-4-nitro-phenyl)-4,6,8-trimethyl-azulene

Systemtic Name: 1-(3,5-dimethyl-4-nitro-phenyl)-4,6,8-trimethyl-azulene Openeye Name: 1-(3,5-dimethyl-4-nitro-phenyl)-4,6,8-trimethyl-azulene CAS Name: 1-(3,5-dimethyl-4-nitrophenyl)-4,6,8-trimethylazulene IUPAC Name: 1-(3,5-dimethyl-4-nitrophenyl)-4,6,8-trimethylazulene Traditional Name: 1-(3,5-dimethyl-4-nitro-phenyl)-4,6,8-trimethyl-azulene Formula: C21H21NO2 MolecularWeight: 319.39694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C=CC(=C2C(=C1)C)C3=CC(=C(C(=C3)C)[N+](=O)[O-])C)C

Isomeric SMILES

CC1=CC(=C2C=CC(=C2C(=C1)C)C3=CC(=C(C(=C3)C)[N+](=O)[O-])C)C

InChI

InChI=1S/C21H21NO2/c1-12-8-13(2)18-6-7-19(20(18)14(3)9-12)17-10-15(4)21(22(23)24)16(5)11-17/h6-11H,1-5H3