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1-[(4-ethylphenyl)-thiophen-3-yl-methyl]pyrrolidine-2-carboxylic acid

1-[(4-ethylphenyl)-thiophen-3-yl-methyl]pyrrolidine-2-carboxylic acid

Systemtic Name:1-[(4-ethylphenyl)-thiophen-3-yl-methyl]pyrrolidine-2-carboxylic acid
Openeye Name:1-[(4-ethylphenyl)-(3-thienyl)methyl]pyrrolidine-2-carboxylic acid
CAS Name:1-[(4-ethylphenyl)-(3-thiophenyl)methyl]-2-pyrrolidinecarboxylic acid
IUPAC Name:1-[(4-ethylphenyl)-thiophen-3-ylmethyl]pyrrolidine-2-carboxylic acid
Traditional Name:1-[(4-ethylphenyl)-(3-thienyl)methyl]proline
Formula: C18H21NO2S
MolecularWeight: 315.42984
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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C2=CSC=C2)N3CCCC3C(=O)O


Isomeric SMILES

CCC1=CC=C(C=C1)C(C2=CSC=C2)N3CCCC3C(=O)O


InChI

InChI=1S/C18H21NO2S/c1-2-13-5-7-14(8-6-13)17(15-9-11-22-12-15)19-10-3-4-16(19)18(20)21/h5-9,11-12,16-17H,2-4,10H2,1H3,(H,20,21)


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