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

Systemtic Name: 4-[2-oxidanylidene-2-[1-(2-piperidin-1-ylphenyl)butylamino]ethyl]-2-propoxy-benzoic acid Openeye Name: 4-[2-oxo-2-[1-[2-(1-piperidyl)phenyl]butylamino]ethyl]-2-propoxy-benzoic acid CAS Name: 4-[2-oxo-2-[1-[2-(1-piperidinyl)phenyl]butylamino]ethyl]-2-propoxybenzoic acid IUPAC Name: 4-[2-oxo-2-[1-(2-piperidin-1-ylphenyl)butylamino]ethyl]-2-propoxybenzoic acid Traditional Name: 4-[2-keto-2-[1-(2-piperidinophenyl)butylamino]ethyl]-2-propoxy-benzoic acid Formula: C27H36N2O4 MolecularWeight: 452.58574

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1N2CCCCC2)NC(=O)CC3=CC(=C(C=C3)C(=O)O)OCCC

Isomeric SMILES

CCCC(C1=CC=CC=C1N2CCCCC2)NC(=O)CC3=CC(=C(C=C3)C(=O)O)OCCC

InChI

InChI=1S/C27H36N2O4/c1-3-10-23(21-11-6-7-12-24(21)29-15-8-5-9-16-29)28-26(30)19-20-13-14-22(27(31)32)25(18-20)33-17-4-2/h6-7,11-14,18,23H,3-5,8-10,15-17,19H2,1-2H3,(H,28,30)(H,31,32)