methyl 2-[(3S,5S)-5-[[4-[4-[(Z)-N'-decoxycarbonylcarbamimidoyl]phenyl]phenoxy]methyl]-2-oxidanylidene-pyrrolidin-3-yl]ethanoate

Systemtic Name: methyl 2-[(3S,5S)-5-[[4-[4-[(Z)-N'-decoxycarbonylcarbamimidoyl]phenyl]phenoxy]methyl]-2-oxidanylidene-pyrrolidin-3-yl]ethanoate Openeye Name: methyl 2-[(3S,5S)-5-[[4-[4-[(Z)-N'-decoxycarbonylcarbamimidoyl]phenyl]phenoxy]methyl]-2-oxo-pyrrolidin-3-yl]acetate CAS Name: 2-[(3S,5S)-5-[[4-[4-[(Z)-amino-[decoxy(oxo)methyl]iminomethyl]phenyl]phenoxy]methyl]-2-oxo-3-pyrrolidinyl]acetic acid methyl ester IUPAC Name: methyl 2-[(3S,5S)-5-[[4-[4-[(Z)-N'-decoxycarbonylcarbamimidoyl]phenyl]phenoxy]methyl]-2-oxopyrrolidin-3-yl]acetate Traditional Name: 2-[(3S,5S)-5-[[4-[4-[(Z)-N'-decoxycarbonylamidino]phenyl]phenoxy]methyl]-2-keto-pyrrolidin-3-yl]acetic acid methyl ester Formula: C32H43N3O6 MolecularWeight: 565.70032

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCCCCCCCOC(=O)/N=C(/C1=CC=C(C=C1)C2=CC=C(C=C2)OC[C@@H]3C[C@H](C(=O)N3)CC(=O)OC)\N

InChI

InChI=1S/C32H43N3O6/c1-3-4-5-6-7-8-9-10-19-40-32(38)35-30(33)25-13-11-23(12-14-25)24-15-17-28(18-16-24)41-22-27-20-26(31(37)34-27)21-29(36)39-2/h11-18,26-27H,3-10,19-22H2,1-2H3,(H,34,37)(H2,33,35,38)/t26-,27-/m0/s1