3-[1,3-bis(oxidanylidene)isoindol-2-yl]propyl 3-[(4-methylphenyl)methylcarbamoylamino]benzoate

Systemtic Name: 3-[1,3-bis(oxidanylidene)isoindol-2-yl]propyl 3-[(4-methylphenyl)methylcarbamoylamino]benzoate Openeye Name: 3-(1,3-dioxoisoindolin-2-yl)propyl 3-(p-tolylmethylcarbamoylamino)benzoate CAS Name: 3-[[[(4-methylphenyl)methylamino]-oxomethyl]amino]benzoic acid 3-(1,3-dioxo-2-isoindolyl)propyl ester IUPAC Name: 3-(1,3-dioxoisoindol-2-yl)propyl 3-[(4-methylphenyl)methylcarbamoylamino]benzoate Traditional Name: 3-[(4-methylbenzyl)carbamoylamino]benzoic acid 3-phthalimidopropyl ester Formula: C27H25N3O5 MolecularWeight: 471.5045

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)NC2=CC=CC(=C2)C(=O)OCCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)NC2=CC=CC(=C2)C(=O)OCCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C27H25N3O5/c1-18-10-12-19(13-11-18)17-28-27(34)29-21-7-4-6-20(16-21)26(33)35-15-5-14-30-24(31)22-8-2-3-9-23(22)25(30)32/h2-4,6-13,16H,5,14-15,17H2,1H3,(H2,28,29,34)