propanoyloxymethyl 4-[2-carbamimidoyl-4-[(2-oxidanylidenepyrrolidin-1-yl)methoxy]phenyl]benzoate

Systemtic Name: propanoyloxymethyl 4-[2-carbamimidoyl-4-[(2-oxidanylidenepyrrolidin-1-yl)methoxy]phenyl]benzoate Openeye Name: propanoyloxymethyl 4-[2-carbamimidoyl-4-[(2-oxopyrrolidin-1-yl)methoxy]phenyl]benzoate CAS Name: 4-[2-carbamimidoyl-4-[(2-oxo-1-pyrrolidinyl)methoxy]phenyl]benzoic acid 1-oxopropoxymethyl ester IUPAC Name: propanoyloxymethyl 4-[2-carbamimidoyl-4-[(2-oxopyrrolidin-1-yl)methoxy]phenyl]benzoate Traditional Name: 4-[2-amidino-4-[(2-ketopyrrolidino)methoxy]phenyl]benzoic acid propionyloxymethyl ester Formula: C23H25N3O6 MolecularWeight: 439.4611

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OCOC(=O)C1=CC=C(C=C1)C2=C(C=C(C=C2)OCN3CCCC3=O)C(=N)N

Isomeric SMILES

CCC(=O)OCOC(=O)C1=CC=C(C=C1)C2=C(C=C(C=C2)OCN3CCCC3=O)C(=N)N

InChI

InChI=1S/C23H25N3O6/c1-2-21(28)31-14-32-23(29)16-7-5-15(6-8-16)18-10-9-17(12-19(18)22(24)25)30-13-26-11-3-4-20(26)27/h5-10,12H,2-4,11,13-14H2,1H3,(H3,24,25)