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

Systemtic Name: methyl 4-[2-carbamimidoyl-4-[[4-(2-methoxy-2-oxidanylidene-ethyl)-5-oxidanylidene-pyrrolidin-2-yl]methoxy]phenyl]benzoate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C23H25N3O6 MolecularWeight: 439.4611

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1CC(NC1=O)COC2=CC(=C(C=C2)C3=CC=C(C=C3)C(=O)OC)C(=N)N

Isomeric SMILES

COC(=O)CC1CC(NC1=O)COC2=CC(=C(C=C2)C3=CC=C(C=C3)C(=O)OC)C(=N)N

InChI

InChI=1S/C23H25N3O6/c1-30-20(27)10-15-9-16(26-22(15)28)12-32-17-7-8-18(19(11-17)21(24)25)13-3-5-14(6-4-13)23(29)31-2/h3-8,11,15-16H,9-10,12H2,1-2H3,(H3,24,25)(H,26,28)