2-[3-azanylidene-6-ethoxy-5-(methylcarbamoyl)-1H-isoindol-2-yl]-2-(7-methoxy-3,3-dimethyl-2H-indol-1-yl)-3-oxidanylidene-butanoic acid

Systemtic Name: 2-[3-azanylidene-6-ethoxy-5-(methylcarbamoyl)-1H-isoindol-2-yl]-2-(7-methoxy-3,3-dimethyl-2H-indol-1-yl)-3-oxidanylidene-butanoic acid Openeye Name: 2-[5-ethoxy-1-imino-6-(methylcarbamoyl)isoindolin-2-yl]-2-(7-methoxy-3,3-dimethyl-indolin-1-yl)-3-oxo-butanoic acid CAS Name: 2-[6-ethoxy-3-imino-5-(methylcarbamoyl)-1H-isoindol-2-yl]-2-(7-methoxy-3,3-dimethyl-2H-indol-1-yl)-3-oxobutanoic acid IUPAC Name: 2-[6-ethoxy-3-imino-5-(methylcarbamoyl)-1H-isoindol-2-yl]-2-(7-methoxy-3,3-dimethyl-2H-indol-1-yl)-3-oxobutanoic acid Traditional Name: 2-[5-ethoxy-1-imino-6-(methylcarbamoyl)isoindolin-2-yl]-3-keto-2-(7-methoxy-3,3-dimethyl-indolin-1-yl)butyric acid Formula: C27H32N4O6 MolecularWeight: 508.56618

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CN(C2=N)C(C(=O)C)(C(=O)O)N3CC(C4=C3C(=CC=C4)OC)(C)C)C(=O)NC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)CN(C2=N)C(C(=O)C)(C(=O)O)N3CC(C4=C3C(=CC=C4)OC)(C)C)C(=O)NC

InChI

InChI=1S/C27H32N4O6/c1-7-37-21-11-16-13-30(23(28)17(16)12-18(21)24(33)29-5)27(15(2)32,25(34)35)31-14-26(3,4)19-9-8-10-20(36-6)22(19)31/h8-12,28H,7,13-14H2,1-6H3,(H,29,33)(H,34,35)