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3-[2-carboxyethyl-[3-(ethylcarbamoylamino)phenyl]amino]propanoic acid

3-[2-carboxyethyl-[3-(ethylcarbamoylamino)phenyl]amino]propanoic acid

Systemtic Name:3-[2-carboxyethyl-[3-(ethylcarbamoylamino)phenyl]amino]propanoic acid
Openeye Name:3-[N-(2-carboxyethyl)-3-(ethylcarbamoylamino)anilino]propanoic acid
CAS Name:3-[N-(2-carboxyethyl)-3-(ethylcarbamoylamino)anilino]propanoic acid
IUPAC Name:3-[N-(2-carboxyethyl)-3-(ethylcarbamoylamino)anilino]propanoic acid
Traditional Name:3-[N-(2-carboxyethyl)-3-(ethylcarbamoylamino)anilino]propionic acid
Formula: C15H21N3O5
MolecularWeight: 323.34434
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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC1=CC(=CC=C1)N(CCC(=O)O)CCC(=O)O


Isomeric SMILES

CCNC(=O)NC1=CC(=CC=C1)N(CCC(=O)O)CCC(=O)O


InChI

InChI=1S/C15H21N3O5/c1-2-16-15(23)17-11-4-3-5-12(10-11)18(8-6-13(19)20)9-7-14(21)22/h3-5,10H,2,6-9H2,1H3,(H,19,20)(H,21,22)(H2,16,17,23)


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