diethyl-[2-[4-[3-(phenylcarbamoylimino)-1H-isoindol-2-yl]phenyl]carbonyloxyethyl]azanium

Systemtic Name: diethyl-[2-[4-[3-(phenylcarbamoylimino)-1H-isoindol-2-yl]phenyl]carbonyloxyethyl]azanium Openeye Name: diethyl-[2-[4-[1-(phenylcarbamoylimino)isoindolin-2-yl]benzoyl]oxyethyl]ammonium CAS Name: 2-[[4-[3-[anilino(oxo)methyl]imino-1H-isoindol-2-yl]phenyl]-oxomethoxy]ethyl-diethylammonium IUPAC Name: diethyl-[2-[4-[3-(phenylcarbamoylimino)-1H-isoindol-2-yl]benzoyl]oxyethyl]azanium Traditional Name: diethyl-[2-[4-[1-(phenylcarbamoylimino)isoindolin-2-yl]benzoyl]oxyethyl]ammonium Formula: C28H31N4O3+ MolecularWeight: 471.57074

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCOC(=O)C1=CC=C(C=C1)N2CC3=CC=CC=C3C2=NC(=O)NC4=CC=CC=C4

Isomeric SMILES

CC[NH+](CC)CCOC(=O)C1=CC=C(C=C1)N2CC3=CC=CC=C3C2=NC(=O)NC4=CC=CC=C4

InChI

InChI=1S/C28H30N4O3/c1-3-31(4-2)18-19-35-27(33)21-14-16-24(17-15-21)32-20-22-10-8-9-13-25(22)26(32)30-28(34)29-23-11-6-5-7-12-23/h5-17H,3-4,18-20H2,1-2H3,(H,29,34)/p+1