2-cyclohexylethyl 2-[1-[[4-(4-carbamimidoylphenyl)phenoxy]methyl]-2-oxidanylidene-pyrrolidin-3-yl]ethanoate

Systemtic Name: 2-cyclohexylethyl 2-[1-[[4-(4-carbamimidoylphenyl)phenoxy]methyl]-2-oxidanylidene-pyrrolidin-3-yl]ethanoate Openeye Name: 2-cyclohexylethyl 2-[1-[[4-(4-carbamimidoylphenyl)phenoxy]methyl]-2-oxo-pyrrolidin-3-yl]acetate CAS Name: 2-[1-[[4-(4-carbamimidoylphenyl)phenoxy]methyl]-2-oxo-3-pyrrolidinyl]acetic acid 2-cyclohexylethyl ester IUPAC Name: 2-cyclohexylethyl 2-[1-[[4-(4-carbamimidoylphenyl)phenoxy]methyl]-2-oxopyrrolidin-3-yl]acetate Traditional Name: 2-[1-[[4-(4-amidinophenyl)phenoxy]methyl]-2-keto-pyrrolidin-3-yl]acetic acid 2-cyclohexylethyl ester Formula: C28H35N3O4 MolecularWeight: 477.5952

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCOC(=O)CC2CCN(C2=O)COC3=CC=C(C=C3)C4=CC=C(C=C4)C(=N)N

Isomeric SMILES

C1CCC(CC1)CCOC(=O)CC2CCN(C2=O)COC3=CC=C(C=C3)C4=CC=C(C=C4)C(=N)N

InChI

InChI=1S/C28H35N3O4/c29-27(30)23-8-6-21(7-9-23)22-10-12-25(13-11-22)35-19-31-16-14-24(28(31)33)18-26(32)34-17-15-20-4-2-1-3-5-20/h6-13,20,24H,1-5,14-19H2,(H3,29,30)