2-[2-[[4-(4-carbamimidoylphenyl)phenoxy]methyl]-1-methyl-pyrrolidin-3-yl]ethanoic acid

Systemtic Name: 2-[2-[[4-(4-carbamimidoylphenyl)phenoxy]methyl]-1-methyl-pyrrolidin-3-yl]ethanoic acid Openeye Name: 2-[2-[[4-(4-carbamimidoylphenyl)phenoxy]methyl]-1-methyl-pyrrolidin-3-yl]acetic acid CAS Name: 2-[2-[[4-(4-carbamimidoylphenyl)phenoxy]methyl]-1-methyl-3-pyrrolidinyl]acetic acid IUPAC Name: 2-[2-[[4-(4-carbamimidoylphenyl)phenoxy]methyl]-1-methylpyrrolidin-3-yl]acetic acid Traditional Name: 2-[2-[[4-(4-amidinophenyl)phenoxy]methyl]-1-methyl-pyrrolidin-3-yl]acetic acid Formula: C21H25N3O3 MolecularWeight: 367.4415

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(C1COC2=CC=C(C=C2)C3=CC=C(C=C3)C(=N)N)CC(=O)O

Isomeric SMILES

CN1CCC(C1COC2=CC=C(C=C2)C3=CC=C(C=C3)C(=N)N)CC(=O)O

InChI

InChI=1S/C21H25N3O3/c1-24-11-10-17(12-20(25)26)19(24)13-27-18-8-6-15(7-9-18)14-2-4-16(5-3-14)21(22)23/h2-9,17,19H,10-13H2,1H3,(H3,22,23)(H,25,26)