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4-[3-[3-(pyrrolidin-1-ylmethyl)phenoxy]propylcarbamoyl]benzoic acid

4-[3-[3-(pyrrolidin-1-ylmethyl)phenoxy]propylcarbamoyl]benzoic acid

Systemtic Name:4-[3-[3-(pyrrolidin-1-ylmethyl)phenoxy]propylcarbamoyl]benzoic acid
Openeye Name:4-[3-[3-(pyrrolidin-1-ylmethyl)phenoxy]propylcarbamoyl]benzoic acid
CAS Name:4-[oxo-[3-[3-(1-pyrrolidinylmethyl)phenoxy]propylamino]methyl]benzoic acid
IUPAC Name:4-[3-[3-(pyrrolidin-1-ylmethyl)phenoxy]propylcarbamoyl]benzoic acid
Traditional Name:4-[3-[3-(pyrrolidinomethyl)phenoxy]propylcarbamoyl]benzoic acid
Formula: C22H26N2O4
MolecularWeight: 382.45284
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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC(=CC=C2)OCCCNC(=O)C3=CC=C(C=C3)C(=O)O


Isomeric SMILES

C1CCN(C1)CC2=CC(=CC=C2)OCCCNC(=O)C3=CC=C(C=C3)C(=O)O


InChI

InChI=1S/C22H26N2O4/c25-21(18-7-9-19(10-8-18)22(26)27)23-11-4-14-28-20-6-3-5-17(15-20)16-24-12-1-2-13-24/h3,5-10,15H,1-2,4,11-14,16H2,(H,23,25)(H,26,27)


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