3-[2-(1-methylidene-3-oxidanylidene-isoindol-2-yl)ethanoylamino]-4-pyrrolidin-1-yl-benzamide

Systemtic Name: 3-[2-(1-methylidene-3-oxidanylidene-isoindol-2-yl)ethanoylamino]-4-pyrrolidin-1-yl-benzamide Openeye Name: 3-[[2-(1-methylene-3-oxo-isoindolin-2-yl)acetyl]amino]-4-pyrrolidin-1-yl-benzamide CAS Name: 3-[[2-(1-methylene-3-oxo-2-isoindolyl)-1-oxoethyl]amino]-4-(1-pyrrolidinyl)benzamide IUPAC Name: 3-[[2-(1-methylidene-3-oxoisoindol-2-yl)acetyl]amino]-4-pyrrolidin-1-ylbenzamide Traditional Name: 3-[[2-(1-keto-3-methylene-isoindolin-2-yl)acetyl]amino]-4-pyrrolidino-benzamide Formula: C22H22N4O3 MolecularWeight: 390.43508

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Descriptors Computed from Structure

Canonical SMILES:

C=C1C2=CC=CC=C2C(=O)N1CC(=O)NC3=C(C=CC(=C3)C(=O)N)N4CCCC4

Isomeric SMILES

C=C1C2=CC=CC=C2C(=O)N1CC(=O)NC3=C(C=CC(=C3)C(=O)N)N4CCCC4

InChI

InChI=1S/C22H22N4O3/c1-14-16-6-2-3-7-17(16)22(29)26(14)13-20(27)24-18-12-15(21(23)28)8-9-19(18)25-10-4-5-11-25/h2-3,6-9,12H,1,4-5,10-11,13H2,(H2,23,28)(H,24,27)