[(2S)-1-hexyl-2-(3-methoxyphenyl)-4,5-bis(oxidanylidene)pyrrolidin-3-ylidene]-phenyl-methanolate

Systemtic Name: [(2S)-1-hexyl-2-(3-methoxyphenyl)-4,5-bis(oxidanylidene)pyrrolidin-3-ylidene]-phenyl-methanolate Openeye Name: [(2S)-1-hexyl-2-(3-methoxyphenyl)-4,5-dioxo-pyrrolidin-3-ylidene]-phenyl-methanolate CAS Name: [(2S)-1-hexyl-2-(3-methoxyphenyl)-4,5-dioxo-3-pyrrolidinylidene]-phenylmethanolate IUPAC Name: [(2S)-1-hexyl-2-(3-methoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene]-phenylmethanolate Traditional Name: [(2S)-1-hexyl-4,5-diketo-2-(3-methoxyphenyl)pyrrolidin-3-ylidene]-phenyl-methanolate Formula: C24H26NO4- MolecularWeight: 392.46754

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(C(=C(C2=CC=CC=C2)[O-])C(=O)C1=O)C3=CC(=CC=C3)OC

Isomeric SMILES

CCCCCCN1[C@H](C(=C(C2=CC=CC=C2)[O-])C(=O)C1=O)C3=CC(=CC=C3)OC

InChI

InChI=1S/C24H27NO4/c1-3-4-5-9-15-25-21(18-13-10-14-19(16-18)29-2)20(23(27)24(25)28)22(26)17-11-7-6-8-12-17/h6-8,10-14,16,21,26H,3-5,9,15H2,1-2H3/p-1/t21-/m0/s1