[[3-(1-aminocarbonyl-3-oxidanylidene-3a,7a-dihydro-1H-isoindol-2-yl)-3-(3-ethoxy-4-methoxy-phenyl)propanoyl]amino] 2,2-dimethylpropanoate

Systemtic Name: [[3-(1-aminocarbonyl-3-oxidanylidene-3a,7a-dihydro-1H-isoindol-2-yl)-3-(3-ethoxy-4-methoxy-phenyl)propanoyl]amino] 2,2-dimethylpropanoate Openeye Name: [[3-(1-carbamoyl-3-oxo-3a,7a-dihydro-1H-isoindol-2-yl)-3-(3-ethoxy-4-methoxy-phenyl)propanoyl]amino] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [[3-(1-carbamoyl-3-oxo-3a,7a-dihydro-1H-isoindol-2-yl)-3-(3-ethoxy-4-methoxyphenyl)-1-oxopropyl]amino] ester IUPAC Name: [[3-(1-carbamoyl-3-oxo-3a,7a-dihydro-1H-isoindol-2-yl)-3-(3-ethoxy-4-methoxyphenyl)propanoyl]amino] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [[3-(1-carbamoyl-3-keto-3a,7a-dihydro-1H-isoindol-2-yl)-3-(3-ethoxy-4-methoxy-phenyl)propanoyl]amino] ester Formula: C26H33N3O7 MolecularWeight: 499.55612

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(CC(=O)NOC(=O)C(C)(C)C)N2C(C3C=CC=CC3C2=O)C(=O)N)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(CC(=O)NOC(=O)C(C)(C)C)N2C(C3C=CC=CC3C2=O)C(=O)N)OC

InChI

InChI=1S/C26H33N3O7/c1-6-35-20-13-15(11-12-19(20)34-5)18(14-21(30)28-36-25(33)26(2,3)4)29-22(23(27)31)16-9-7-8-10-17(16)24(29)32/h7-13,16-18,22H,6,14H2,1-5H3,(H2,27,31)(H,28,30)