2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(4-butan-2-ylphenyl)-3-(4-nitrophenyl)propanamide

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(4-butan-2-ylphenyl)-3-(4-nitrophenyl)propanamide Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)-3-(4-nitrophenyl)-N-(4-sec-butylphenyl)propanamide CAS Name: N-(4-butan-2-ylphenyl)-2-(1,3-dioxo-2-isoindolyl)-3-(4-nitrophenyl)propanamide IUPAC Name: N-(4-butan-2-ylphenyl)-2-(1,3-dioxoisoindol-2-yl)-3-(4-nitrophenyl)propanamide Traditional Name: 3-(4-nitrophenyl)-2-phthalimido-N-(4-sec-butylphenyl)propionamide Formula: C27H25N3O5 MolecularWeight: 471.5045

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC(=O)C(CC2=CC=C(C=C2)[N+](=O)[O-])N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)NC(=O)C(CC2=CC=C(C=C2)[N+](=O)[O-])N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C27H25N3O5/c1-3-17(2)19-10-12-20(13-11-19)28-25(31)24(16-18-8-14-21(15-9-18)30(34)35)29-26(32)22-6-4-5-7-23(22)27(29)33/h4-15,17,24H,3,16H2,1-2H3,(H,28,31)