(5R)-2-[C-butyl-N-[2-(2-methyl-1H-indol-3-yl)ethyl]carbonimidoyl]-3-oxidanylidene-5-phenyl-cyclohexen-1-olate

Systemtic Name: (5R)-2-[C-butyl-N-[2-(2-methyl-1H-indol-3-yl)ethyl]carbonimidoyl]-3-oxidanylidene-5-phenyl-cyclohexen-1-olate Openeye Name: (5R)-2-[C-butyl-N-[2-(2-methyl-1H-indol-3-yl)ethyl]carbonimidoyl]-3-oxo-5-phenyl-cyclohexen-1-olate CAS Name: (5R)-2-[1-[2-(2-methyl-1H-indol-3-yl)ethylimino]pentyl]-3-oxo-5-phenyl-1-cyclohexenolate IUPAC Name: (5R)-2-[C-butyl-N-[2-(2-methyl-1H-indol-3-yl)ethyl]carbonimidoyl]-3-oxo-5-phenylcyclohexen-1-olate Traditional Name: (5R)-2-[C-butyl-N-[2-(2-methyl-1H-indol-3-yl)ethyl]carbonimidoyl]-3-keto-5-phenyl-cyclohexen-1-olate Formula: C28H31N2O2- MolecularWeight: 427.55794

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=NCCC1=C(NC2=CC=CC=C21)C)C3=C(CC(CC3=O)C4=CC=CC=C4)[O-]

Isomeric SMILES

CCCCC(=NCCC1=C(NC2=CC=CC=C21)C)C3=C(C[C@H](CC3=O)C4=CC=CC=C4)[O-]

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/h5-12,14,21,30-31H,3-4,13,15-18H2,1-2H3/p-1/t21-/m1/s1