2-[4-carbamimidoyl-2-[2-[4-(1-ethanimidoylpiperidin-4-yl)oxyphenyl]carbonyloxyethoxy]phenoxy]ethanoic acid

Systemtic Name: 2-[4-carbamimidoyl-2-[2-[4-(1-ethanimidoylpiperidin-4-yl)oxyphenyl]carbonyloxyethoxy]phenoxy]ethanoic acid Openeye Name: 2-[4-carbamimidoyl-2-[2-[4-[(1-ethanimidoyl-4-piperidyl)oxy]benzoyl]oxyethoxy]phenoxy]acetic acid CAS Name: 2-[4-carbamimidoyl-2-[2-[[4-[[1-(1-iminoethyl)-4-piperidinyl]oxy]phenyl]-oxomethoxy]ethoxy]phenoxy]acetic acid IUPAC Name: 2-[4-carbamimidoyl-2-[2-[4-(1-ethanimidoylpiperidin-4-yl)oxybenzoyl]oxyethoxy]phenoxy]acetic acid Traditional Name: 2-[2-[2-[4-[(1-acetimidoyl-4-piperidyl)oxy]benzoyl]oxyethoxy]-4-amidino-phenoxy]acetic acid Formula: C25H30N4O7 MolecularWeight: 498.5283

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)N1CCC(CC1)OC2=CC=C(C=C2)C(=O)OCCOC3=C(C=CC(=C3)C(=N)N)OCC(=O)O

Isomeric SMILES

CC(=N)N1CCC(CC1)OC2=CC=C(C=C2)C(=O)OCCOC3=C(C=CC(=C3)C(=N)N)OCC(=O)O

InChI

InChI=1S/C25H30N4O7/c1-16(26)29-10-8-20(9-11-29)36-19-5-2-17(3-6-19)25(32)34-13-12-33-22-14-18(24(27)28)4-7-21(22)35-15-23(30)31/h2-7,14,20,26H,8-13,15H2,1H3,(H3,27,28)(H,30,31)