2-cyclohexyl-1,3-bis(oxidanylidene)-N-[1-(phenylmethyl)pyrrolidin-3-yl]isoindole-5-carboxamide

Systemtic Name: 2-cyclohexyl-1,3-bis(oxidanylidene)-N-[1-(phenylmethyl)pyrrolidin-3-yl]isoindole-5-carboxamide Openeye Name: N-(1-benzylpyrrolidin-3-yl)-2-cyclohexyl-1,3-dioxo-isoindoline-5-carboxamide CAS Name: 2-cyclohexyl-1,3-dioxo-N-[1-(phenylmethyl)-3-pyrrolidinyl]-5-isoindolecarboxamide IUPAC Name: N-(1-benzylpyrrolidin-3-yl)-2-cyclohexyl-1,3-dioxoisoindole-5-carboxamide Traditional Name: N-(1-benzylpyrrolidin-3-yl)-2-cyclohexyl-1,3-diketo-isoindoline-5-carboxamide Formula: C26H29N3O3 MolecularWeight: 431.52676

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NC4CCN(C4)CC5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NC4CCN(C4)CC5=CC=CC=C5

InChI

InChI=1S/C26H29N3O3/c30-24(27-20-13-14-28(17-20)16-18-7-3-1-4-8-18)19-11-12-22-23(15-19)26(32)29(25(22)31)21-9-5-2-6-10-21/h1,3-4,7-8,11-12,15,20-21H,2,5-6,9-10,13-14,16-17H2,(H,27,30)