methyl 2-[5-[[4-(4-carbamimidoylphenyl)phenoxy]methyl]-1-ethanoyl-pyrrolidin-3-yl]ethanoate

Systemtic Name: methyl 2-[5-[[4-(4-carbamimidoylphenyl)phenoxy]methyl]-1-ethanoyl-pyrrolidin-3-yl]ethanoate Openeye Name: methyl 2-[1-acetyl-5-[[4-(4-carbamimidoylphenyl)phenoxy]methyl]pyrrolidin-3-yl]acetate CAS Name: 2-[1-acetyl-5-[[4-(4-carbamimidoylphenyl)phenoxy]methyl]-3-pyrrolidinyl]acetic acid methyl ester IUPAC Name: methyl 2-[1-acetyl-5-[[4-(4-carbamimidoylphenyl)phenoxy]methyl]pyrrolidin-3-yl]acetate Traditional Name: 2-[1-acetyl-5-[[4-(4-amidinophenyl)phenoxy]methyl]pyrrolidin-3-yl]acetic acid methyl ester Formula: C23H27N3O4 MolecularWeight: 409.47818

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC(CC1COC2=CC=C(C=C2)C3=CC=C(C=C3)C(=N)N)CC(=O)OC

Isomeric SMILES

CC(=O)N1CC(CC1COC2=CC=C(C=C2)C3=CC=C(C=C3)C(=N)N)CC(=O)OC

InChI

InChI=1S/C23H27N3O4/c1-15(27)26-13-16(12-22(28)29-2)11-20(26)14-30-21-9-7-18(8-10-21)17-3-5-19(6-4-17)23(24)25/h3-10,16,20H,11-14H2,1-2H3,(H3,24,25)