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4-azanyl-1-[(4-dodecylphenyl)methyl]pyrrolidine-2,4-dicarboxylic acid

4-azanyl-1-[(4-dodecylphenyl)methyl]pyrrolidine-2,4-dicarboxylic acid

Systemtic Name:4-azanyl-1-[(4-dodecylphenyl)methyl]pyrrolidine-2,4-dicarboxylic acid
Openeye Name:4-amino-1-[(4-dodecylphenyl)methyl]pyrrolidine-2,4-dicarboxylic acid
CAS Name:4-amino-1-[(4-dodecylphenyl)methyl]pyrrolidine-2,4-dicarboxylic acid
IUPAC Name:4-amino-1-[(4-dodecylphenyl)methyl]pyrrolidine-2,4-dicarboxylic acid
Traditional Name:4-amino-1-(4-laurylbenzyl)pyrrolidine-2,4-dicarboxylic acid
Formula: C25H40N2O4
MolecularWeight: 432.5961
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)CN2CC(CC2C(=O)O)(C(=O)O)N


Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)CN2CC(CC2C(=O)O)(C(=O)O)N


InChI

InChI=1S/C25H40N2O4/c1-2-3-4-5-6-7-8-9-10-11-12-20-13-15-21(16-14-20)18-27-19-25(26,24(30)31)17-22(27)23(28)29/h13-16,22H,2-12,17-19,26H2,1H3,(H,28,29)(H,30,31)


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