acetyloxymethyl 4-[2-carbamimidoyl-4-[[4-(2-methoxy-2-oxidanylidene-ethyl)-5-oxidanylidene-pyrrolidin-2-yl]methoxy]phenyl]benzoate

Systemtic Name: acetyloxymethyl 4-[2-carbamimidoyl-4-[[4-(2-methoxy-2-oxidanylidene-ethyl)-5-oxidanylidene-pyrrolidin-2-yl]methoxy]phenyl]benzoate Openeye Name: acetoxymethyl 4-[2-carbamimidoyl-4-[[4-(2-methoxy-2-oxo-ethyl)-5-oxo-pyrrolidin-2-yl]methoxy]phenyl]benzoate CAS Name: 4-[2-carbamimidoyl-4-[[4-(2-methoxy-2-oxoethyl)-5-oxo-2-pyrrolidinyl]methoxy]phenyl]benzoic acid acetyloxymethyl ester IUPAC Name: acetyloxymethyl 4-[2-carbamimidoyl-4-[[4-(2-methoxy-2-oxoethyl)-5-oxopyrrolidin-2-yl]methoxy]phenyl]benzoate Traditional Name: 4-[2-amidino-4-[[5-keto-4-(2-keto-2-methoxy-ethyl)pyrrolidin-2-yl]methoxy]phenyl]benzoic acid acetoxymethyl ester Formula: C25H27N3O8 MolecularWeight: 497.49718

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCOC(=O)C1=CC=C(C=C1)C2=C(C=C(C=C2)OCC3CC(C(=O)N3)CC(=O)OC)C(=N)N

Isomeric SMILES

CC(=O)OCOC(=O)C1=CC=C(C=C1)C2=C(C=C(C=C2)OCC3CC(C(=O)N3)CC(=O)OC)C(=N)N

InChI

InChI=1S/C25H27N3O8/c1-14(29)35-13-36-25(32)16-5-3-15(4-6-16)20-8-7-19(11-21(20)23(26)27)34-12-18-9-17(24(31)28-18)10-22(30)33-2/h3-8,11,17-18H,9-10,12-13H2,1-2H3,(H3,26,27)(H,28,31)