3-[1,3-bis(oxidanylidene)benzo[f]isoindol-2-yl]-3-(4-cyclohexyloxy-3-ethoxy-phenyl)propanamide

Systemtic Name: 3-[1,3-bis(oxidanylidene)benzo[f]isoindol-2-yl]-3-(4-cyclohexyloxy-3-ethoxy-phenyl)propanamide Openeye Name: 3-[4-(cyclohexoxy)-3-ethoxy-phenyl]-3-(1,3-dioxobenzo[f]isoindol-2-yl)propanamide CAS Name: 3-(4-cyclohexyloxy-3-ethoxyphenyl)-3-(1,3-dioxo-2-benzo[f]isoindolyl)propanamide IUPAC Name: 3-(4-cyclohexyloxy-3-ethoxyphenyl)-3-(1,3-dioxobenzo[f]isoindol-2-yl)propanamide Traditional Name: 3-[4-(cyclohexoxy)-3-ethoxy-phenyl]-3-(1,3-diketobenz[f]isoindol-2-yl)propionamide Formula: C29H30N2O5 MolecularWeight: 486.5589

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(CC(=O)N)N2C(=O)C3=CC4=CC=CC=C4C=C3C2=O)OC5CCCCC5

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(CC(=O)N)N2C(=O)C3=CC4=CC=CC=C4C=C3C2=O)OC5CCCCC5

InChI

InChI=1S/C29H30N2O5/c1-2-35-26-16-20(12-13-25(26)36-21-10-4-3-5-11-21)24(17-27(30)32)31-28(33)22-14-18-8-6-7-9-19(18)15-23(22)29(31)34/h6-9,12-16,21,24H,2-5,10-11,17H2,1H3,(H2,30,32)