2-[3-azanylidene-6-ethoxy-5-(methylcarbamoyl)-1H-isoindol-2-yl]-2-indol-1-yl-3,3-dimethyl-5-oxidanylidene-hexanoic acid

Systemtic Name: 2-[3-azanylidene-6-ethoxy-5-(methylcarbamoyl)-1H-isoindol-2-yl]-2-indol-1-yl-3,3-dimethyl-5-oxidanylidene-hexanoic acid Openeye Name: 2-[5-ethoxy-1-imino-6-(methylcarbamoyl)isoindolin-2-yl]-2-indol-1-yl-3,3-dimethyl-5-oxo-hexanoic acid CAS Name: 2-[6-ethoxy-3-imino-5-(methylcarbamoyl)-1H-isoindol-2-yl]-2-(1-indolyl)-3,3-dimethyl-5-oxohexanoic acid IUPAC Name: 2-[6-ethoxy-3-imino-5-(methylcarbamoyl)-1H-isoindol-2-yl]-2-indol-1-yl-3,3-dimethyl-5-oxohexanoic acid Traditional Name: 2-[5-ethoxy-1-imino-6-(methylcarbamoyl)isoindolin-2-yl]-2-indol-1-yl-5-keto-3,3-dimethyl-hexanoic acid Formula: C28H32N4O5 MolecularWeight: 504.57748

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CN(C2=N)C(C(=O)O)(C(C)(C)CC(=O)C)N3C=CC4=CC=CC=C43)C(=O)NC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)CN(C2=N)C(C(=O)O)(C(C)(C)CC(=O)C)N3C=CC4=CC=CC=C43)C(=O)NC

InChI

InChI=1S/C28H32N4O5/c1-6-37-23-13-19-16-32(24(29)20(19)14-21(23)25(34)30-5)28(26(35)36,27(3,4)15-17(2)33)31-12-11-18-9-7-8-10-22(18)31/h7-14,29H,6,15-16H2,1-5H3,(H,30,34)(H,35,36)