2-[2-[methyl-[(1S)-1-phenyl-2-pyrrolidin-1-yl-ethyl]amino]-2-oxidanylidene-ethyl]benzoic acid

Systemtic Name: 2-[2-[methyl-[(1S)-1-phenyl-2-pyrrolidin-1-yl-ethyl]amino]-2-oxidanylidene-ethyl]benzoic acid Openeye Name: 2-[2-[methyl-[(1S)-1-phenyl-2-pyrrolidin-1-yl-ethyl]amino]-2-oxo-ethyl]benzoic acid CAS Name: 2-[2-[methyl-[(1S)-1-phenyl-2-(1-pyrrolidinyl)ethyl]amino]-2-oxoethyl]benzoic acid IUPAC Name: 2-[2-[methyl-[(1S)-1-phenyl-2-pyrrolidin-1-ylethyl]amino]-2-oxoethyl]benzoic acid Traditional Name: 2-[2-keto-2-[methyl-[(1S)-1-phenyl-2-pyrrolidino-ethyl]amino]ethyl]benzoic acid Formula: C22H26N2O3 MolecularWeight: 366.45344

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(CN1CCCC1)C2=CC=CC=C2)C(=O)CC3=CC=CC=C3C(=O)O

Isomeric SMILES

CN([C@H](CN1CCCC1)C2=CC=CC=C2)C(=O)CC3=CC=CC=C3C(=O)O

InChI

InChI=1S/C22H26N2O3/c1-23(21(25)15-18-11-5-6-12-19(18)22(26)27)20(16-24-13-7-8-14-24)17-9-3-2-4-10-17/h2-6,9-12,20H,7-8,13-16H2,1H3,(H,26,27)/t20-/m1/s1