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

Systemtic Name: (5S)-2-[C-methyl-N-[2-(2-methyl-5-phenylmethoxy-1H-indol-3-yl)ethyl]carbonimidoyl]-3-oxidanylidene-5-phenyl-cyclohexen-1-olate Openeye Name: (5S)-2-[N-[2-(5-benzyloxy-2-methyl-1H-indol-3-yl)ethyl]-C-methyl-carbonimidoyl]-3-oxo-5-phenyl-cyclohexen-1-olate CAS Name: (5S)-2-[1-[2-(2-methyl-5-phenylmethoxy-1H-indol-3-yl)ethylimino]ethyl]-3-oxo-5-phenyl-1-cyclohexenolate IUPAC Name: (5S)-2-[C-methyl-N-[2-(2-methyl-5-phenylmethoxy-1H-indol-3-yl)ethyl]carbonimidoyl]-3-oxo-5-phenylcyclohexen-1-olate Traditional Name: (5S)-2-[N-[2-(5-benzoxy-2-methyl-1H-indol-3-yl)ethyl]-C-methyl-carbonimidoyl]-3-keto-5-phenyl-cyclohexen-1-olate Formula: C32H31N2O3- MolecularWeight: 491.60014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1)C=CC(=C2)OCC3=CC=CC=C3)CCN=C(C)C4=C(CC(CC4=O)C5=CC=CC=C5)[O-]

Isomeric SMILES

CC1=C(C2=C(N1)C=CC(=C2)OCC3=CC=CC=C3)CCN=C(C)C4=C(C[C@@H](CC4=O)C5=CC=CC=C5)[O-]

InChI

InChI=1S/C32H32N2O3/c1-21-27(28-19-26(13-14-29(28)34-21)37-20-23-9-5-3-6-10-23)15-16-33-22(2)32-30(35)17-25(18-31(32)36)24-11-7-4-8-12-24/h3-14,19,25,34-35H,15-18,20H2,1-2H3/p-1/t25-/m0/s1