3-[4-[[2-(3-methylpyrrolidin-1-yl)phenyl]carbonylamino]cyclohexyl]propanoic acid

Systemtic Name: 3-[4-[[2-(3-methylpyrrolidin-1-yl)phenyl]carbonylamino]cyclohexyl]propanoic acid Openeye Name: 3-[4-[[2-(3-methylpyrrolidin-1-yl)benzoyl]amino]cyclohexyl]propanoic acid CAS Name: 3-[4-[[[2-(3-methyl-1-pyrrolidinyl)phenyl]-oxomethyl]amino]cyclohexyl]propanoic acid IUPAC Name: 3-[4-[[2-(3-methylpyrrolidin-1-yl)benzoyl]amino]cyclohexyl]propanoic acid Traditional Name: 3-[4-[[2-(3-methylpyrrolidino)benzoyl]amino]cyclohexyl]propionic acid Formula: C21H30N2O3 MolecularWeight: 358.4745

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(C1)C2=CC=CC=C2C(=O)NC3CCC(CC3)CCC(=O)O

Isomeric SMILES

CC1CCN(C1)C2=CC=CC=C2C(=O)NC3CCC(CC3)CCC(=O)O

InChI

InChI=1S/C21H30N2O3/c1-15-12-13-23(14-15)19-5-3-2-4-18(19)21(26)22-17-9-6-16(7-10-17)8-11-20(24)25/h2-5,15-17H,6-14H2,1H3,(H,22,26)(H,24,25)