2-aminocarbonyl-3-[2-[1-(N'-ethylcarbamimidoyl)piperidin-4-yl]oxyphenyl]benzoic acid

Systemtic Name: 2-aminocarbonyl-3-[2-[1-(N'-ethylcarbamimidoyl)piperidin-4-yl]oxyphenyl]benzoic acid Openeye Name: 2-carbamoyl-3-[2-[[1-(N'-ethylcarbamimidoyl)-4-piperidyl]oxy]phenyl]benzoic acid CAS Name: 3-[2-[[1-[amino(ethylimino)methyl]-4-piperidinyl]oxy]phenyl]-2-carbamoylbenzoic acid IUPAC Name: 2-carbamoyl-3-[2-[1-(N'-ethylcarbamimidoyl)piperidin-4-yl]oxyphenyl]benzoic acid Traditional Name: 2-carbamoyl-3-[2-[[1-(N'-ethylamidino)-4-piperidyl]oxy]phenyl]benzoic acid Formula: C22H26N4O4 MolecularWeight: 410.46624

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Descriptors Computed from Structure

Canonical SMILES:

CCN=C(N)N1CCC(CC1)OC2=CC=CC=C2C3=C(C(=CC=C3)C(=O)O)C(=O)N

Isomeric SMILES

CCN=C(N)N1CCC(CC1)OC2=CC=CC=C2C3=C(C(=CC=C3)C(=O)O)C(=O)N

InChI

InChI=1S/C22H26N4O4/c1-2-25-22(24)26-12-10-14(11-13-26)30-18-9-4-3-6-15(18)16-7-5-8-17(21(28)29)19(16)20(23)27/h3-9,14H,2,10-13H2,1H3,(H2,23,27)(H2,24,25)(H,28,29)