3-methyl-6-(6-methylhept-5-en-2-yl)-4-[(4-nitrophenyl)amino]-5-oxidanyl-cyclohexa-3,5-diene-1,2-dione

Systemtic Name: 3-methyl-6-(6-methylhept-5-en-2-yl)-4-[(4-nitrophenyl)amino]-5-oxidanyl-cyclohexa-3,5-diene-1,2-dione Openeye Name: 3-(1,5-dimethylhex-4-enyl)-4-hydroxy-6-methyl-5-(4-nitroanilino)-1,2-benzoquinone CAS Name: 5-hydroxy-3-methyl-6-(6-methylhept-5-en-2-yl)-4-(4-nitroanilino)cyclohexa-3,5-diene-1,2-dione IUPAC Name: 5-hydroxy-3-methyl-6-(6-methylhept-5-en-2-yl)-4-(4-nitroanilino)cyclohexa-3,5-diene-1,2-dione Traditional Name: 3-(1,5-dimethylhex-4-enyl)-4-hydroxy-6-methyl-5-(4-nitroanilino)-o-benzoquinone Formula: C21H24N2O5 MolecularWeight: 384.42566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=O)C1=O)C(C)CCC=C(C)C)O)NC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=C(C(=O)C1=O)C(C)CCC=C(C)C)O)NC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C21H24N2O5/c1-12(2)6-5-7-13(3)17-20(25)18(14(4)19(24)21(17)26)22-15-8-10-16(11-9-15)23(27)28/h6,8-11,13,22,25H,5,7H2,1-4H3