2-[[2-[bis(carboxymethyl)amino]cyclohexyl]-[2-[bis(carboxymethyl)amino]-3-(4-ethoxycyclohexyl)propyl]amino]ethanoic acid

Systemtic Name: 2-[[2-[bis(carboxymethyl)amino]cyclohexyl]-[2-[bis(carboxymethyl)amino]-3-(4-ethoxycyclohexyl)propyl]amino]ethanoic acid Openeye Name: 2-[[2-[bis(carboxymethyl)amino]cyclohexyl]-[2-[bis(carboxymethyl)amino]-3-(4-ethoxycyclohexyl)propyl]amino]acetic acid CAS Name: 2-[[2-[bis(carboxymethyl)amino]cyclohexyl]-[2-[bis(carboxymethyl)amino]-3-(4-ethoxycyclohexyl)propyl]amino]acetic acid IUPAC Name: 2-[[2-[bis(carboxymethyl)amino]cyclohexyl]-[2-[bis(carboxymethyl)amino]-3-(4-ethoxycyclohexyl)propyl]amino]acetic acid Traditional Name: 2-[[2-[bis(carboxymethyl)amino]cyclohexyl]-[2-[bis(carboxymethyl)amino]-3-(4-ethoxycyclohexyl)propyl]amino]acetic acid Formula: C27H45N3O11 MolecularWeight: 587.6597

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1CCC(CC1)CC(CN(CC(=O)O)C2CCCCC2N(CC(=O)O)CC(=O)O)N(CC(=O)O)CC(=O)O

Isomeric SMILES

CCOC1CCC(CC1)CC(CN(CC(=O)O)C2CCCCC2N(CC(=O)O)CC(=O)O)N(CC(=O)O)CC(=O)O

InChI

InChI=1S/C27H45N3O11/c1-2-41-20-9-7-18(8-10-20)11-19(28(13-23(31)32)14-24(33)34)12-29(15-25(35)36)21-5-3-4-6-22(21)30(16-26(37)38)17-27(39)40/h18-22H,2-17H2,1H3,(H,31,32)(H,33,34)(H,35,36)(H,37,38)(H,39,40)