methyl 4-[3-[3-(pyrrolidin-1-ylmethyl)phenoxy]propylcarbamoyl]benzoate

Systemtic Name: methyl 4-[3-[3-(pyrrolidin-1-ylmethyl)phenoxy]propylcarbamoyl]benzoate Openeye Name: methyl 4-[3-[3-(pyrrolidin-1-ylmethyl)phenoxy]propylcarbamoyl]benzoate CAS Name: 4-[oxo-[3-[3-(1-pyrrolidinylmethyl)phenoxy]propylamino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[3-[3-(pyrrolidin-1-ylmethyl)phenoxy]propylcarbamoyl]benzoate Traditional Name: 4-[3-[3-(pyrrolidinomethyl)phenoxy]propylcarbamoyl]benzoic acid methyl ester Formula: C23H28N2O4 MolecularWeight: 396.47942

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)NCCCOC2=CC=CC(=C2)CN3CCCC3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)NCCCOC2=CC=CC(=C2)CN3CCCC3

InChI

InChI=1S/C23H28N2O4/c1-28-23(27)20-10-8-19(9-11-20)22(26)24-12-5-15-29-21-7-4-6-18(16-21)17-25-13-2-3-14-25/h4,6-11,16H,2-3,5,12-15,17H2,1H3,(H,24,26)