4-[2-oxidanylidene-2-[1-(2-pyrrolidin-1-ylphenyl)butylamino]ethyl]benzoic acid

Systemtic Name: 4-[2-oxidanylidene-2-[1-(2-pyrrolidin-1-ylphenyl)butylamino]ethyl]benzoic acid Openeye Name: 4-[2-oxo-2-[1-(2-pyrrolidin-1-ylphenyl)butylamino]ethyl]benzoic acid CAS Name: 4-[2-oxo-2-[1-[2-(1-pyrrolidinyl)phenyl]butylamino]ethyl]benzoic acid IUPAC Name: 4-[2-oxo-2-[1-(2-pyrrolidin-1-ylphenyl)butylamino]ethyl]benzoic acid Traditional Name: 4-[2-keto-2-[1-(2-pyrrolidinophenyl)butylamino]ethyl]benzoic acid Formula: C23H28N2O3 MolecularWeight: 380.48002

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1N2CCCC2)NC(=O)CC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CCCC(C1=CC=CC=C1N2CCCC2)NC(=O)CC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C23H28N2O3/c1-2-7-20(19-8-3-4-9-21(19)25-14-5-6-15-25)24-22(26)16-17-10-12-18(13-11-17)23(27)28/h3-4,8-13,20H,2,5-7,14-16H2,1H3,(H,24,26)(H,27,28)