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

Systemtic Name: [[3-(1-aminocarbonyl-7-chloranyl-3-oxidanylidene-3a,7a-dihydro-1H-isoindol-2-yl)-3-(3-ethoxy-4-methoxy-phenyl)propanoyl]amino] ethanoate Openeye Name: [[3-(1-carbamoyl-7-chloro-3-oxo-3a,7a-dihydro-1H-isoindol-2-yl)-3-(3-ethoxy-4-methoxy-phenyl)propanoyl]amino] acetate CAS Name: acetic acid [[3-(1-carbamoyl-7-chloro-3-oxo-3a,7a-dihydro-1H-isoindol-2-yl)-3-(3-ethoxy-4-methoxyphenyl)-1-oxopropyl]amino] ester IUPAC Name: [[3-(1-carbamoyl-7-chloro-3-oxo-3a,7a-dihydro-1H-isoindol-2-yl)-3-(3-ethoxy-4-methoxyphenyl)propanoyl]amino] acetate Traditional Name: acetic acid [[3-(1-carbamoyl-7-chloro-3-keto-3a,7a-dihydro-1H-isoindol-2-yl)-3-(3-ethoxy-4-methoxy-phenyl)propanoyl]amino] ester Formula: C23H26ClN3O7 MolecularWeight: 491.92144

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(CC(=O)NOC(=O)C)N2C(C3C(C2=O)C=CC=C3Cl)C(=O)N)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(CC(=O)NOC(=O)C)N2C(C3C(C2=O)C=CC=C3Cl)C(=O)N)OC

InChI

InChI=1S/C23H26ClN3O7/c1-4-33-18-10-13(8-9-17(18)32-3)16(11-19(29)26-34-12(2)28)27-21(22(25)30)20-14(23(27)31)6-5-7-15(20)24/h5-10,14,16,20-21H,4,11H2,1-3H3,(H2,25,30)(H,26,29)