2-[C-butyl-N-[2-(2-methyl-1H-indol-3-yl)ethyl]carbonimidoyl]-5-phenyl-cyclohexane-1,3-dione

Systemtic Name: 2-[C-butyl-N-[2-(2-methyl-1H-indol-3-yl)ethyl]carbonimidoyl]-5-phenyl-cyclohexane-1,3-dione Openeye Name: 2-[C-butyl-N-[2-(2-methyl-1H-indol-3-yl)ethyl]carbonimidoyl]-5-phenyl-cyclohexane-1,3-dione CAS Name: 2-[1-[2-(2-methyl-1H-indol-3-yl)ethylimino]pentyl]-5-phenylcyclohexane-1,3-dione IUPAC Name: 2-[C-butyl-N-[2-(2-methyl-1H-indol-3-yl)ethyl]carbonimidoyl]-5-phenylcyclohexane-1,3-dione Traditional Name: 2-[C-butyl-N-[2-(2-methyl-1H-indol-3-yl)ethyl]carbonimidoyl]-5-phenyl-cyclohexane-1,3-quinone Formula: C28H32N2O2 MolecularWeight: 428.56588

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=NCCC1=C(NC2=CC=CC=C21)C)C3C(=O)CC(CC3=O)C4=CC=CC=C4

Isomeric SMILES

CCCCC(=NCCC1=C(NC2=CC=CC=C21)C)C3C(=O)CC(CC3=O)C4=CC=CC=C4

InChI

InChI=1S/C28H32N2O2/c1-3-4-13-25(29-16-15-22-19(2)30-24-14-9-8-12-23(22)24)28-26(31)17-21(18-27(28)32)20-10-6-5-7-11-20/h5-12,14,21,28,30H,3-4,13,15-18H2,1-2H3