ethyl 4-[2-(1-methylidene-3-oxidanylidene-isoindol-2-yl)propanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-(1-methylidene-3-oxidanylidene-isoindol-2-yl)propanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-(1-methylene-3-oxo-isoindolin-2-yl)propanoyl]piperazine-1-carboxylate CAS Name: 4-[2-(1-methylene-3-oxo-2-isoindolyl)-1-oxopropyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(1-methylidene-3-oxoisoindol-2-yl)propanoyl]piperazine-1-carboxylate Traditional Name: 4-[2-(1-keto-3-methylene-isoindolin-2-yl)propanoyl]piperazine-1-carboxylic acid ethyl ester Formula: C19H23N3O4 MolecularWeight: 357.40362

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C(C)N2C(=C)C3=CC=CC=C3C2=O

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C(C)N2C(=C)C3=CC=CC=C3C2=O

InChI

InChI=1S/C19H23N3O4/c1-4-26-19(25)21-11-9-20(10-12-21)17(23)14(3)22-13(2)15-7-5-6-8-16(15)18(22)24/h5-8,14H,2,4,9-12H2,1,3H3