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2-[[3-[(E)-octadec-9-enoxy]phenyl]amino]butanedioic acid

2-[[3-[(E)-octadec-9-enoxy]phenyl]amino]butanedioic acid

Systemtic Name:2-[[3-[(E)-octadec-9-enoxy]phenyl]amino]butanedioic acid
Openeye Name:2-[3-[(E)-octadec-9-enoxy]anilino]butanedioic acid
CAS Name:2-[3-[(E)-octadec-9-enoxy]anilino]butanedioic acid
IUPAC Name:2-[3-[(E)-octadec-9-enoxy]anilino]butanedioic acid
Traditional Name:2-[3-[(E)-octadec-9-enoxy]anilino]succinic acid
Formula: C28H45NO5
MolecularWeight: 475.6606
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCOC1=CC=CC(=C1)NC(CC(=O)O)C(=O)O


Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCOC1=CC=CC(=C1)NC(CC(=O)O)C(=O)O


InChI

InChI=1S/C28H45NO5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-34-25-20-18-19-24(22-25)29-26(28(32)33)23-27(30)31/h9-10,18-20,22,26,29H,2-8,11-17,21,23H2,1H3,(H,30,31)(H,32,33)/b10-9+


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