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5-[1-[3-[bis(carboxymethyl)amino]phenoxy]octadecoxy]pentanoic acid

5-[1-[3-[bis(carboxymethyl)amino]phenoxy]octadecoxy]pentanoic acid

Systemtic Name:5-[1-[3-[bis(carboxymethyl)amino]phenoxy]octadecoxy]pentanoic acid
Openeye Name:5-[1-[3-[bis(carboxymethyl)amino]phenoxy]octadecoxy]pentanoic acid
CAS Name:5-[1-[3-[bis(carboxymethyl)amino]phenoxy]octadecoxy]pentanoic acid
IUPAC Name:5-[1-[3-[bis(carboxymethyl)amino]phenoxy]octadecoxy]pentanoic acid
Traditional Name:5-[1-[3-[bis(carboxymethyl)amino]phenoxy]octadecoxy]valeric acid
Formula: C33H55NO8
MolecularWeight: 593.7917
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(OCCCCC(=O)O)OC1=CC=CC(=C1)N(CC(=O)O)CC(=O)O


Isomeric SMILES

CCCCCCCCCCCCCCCCCC(OCCCCC(=O)O)OC1=CC=CC(=C1)N(CC(=O)O)CC(=O)O


InChI

InChI=1S/C33H55NO8/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-23-33(41-24-18-17-22-30(35)36)42-29-21-19-20-28(25-29)34(26-31(37)38)27-32(39)40/h19-21,25,33H,2-18,22-24,26-27H2,1H3,(H,35,36)(H,37,38)(H,39,40)


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