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

Systemtic Name: 4-[2-(ethylamino)-2-oxidanylidene-1-(2-pyrrolidin-1-ylphenyl)ethyl]benzoic acid Openeye Name: 4-[2-(ethylamino)-2-oxo-1-(2-pyrrolidin-1-ylphenyl)ethyl]benzoic acid CAS Name: 4-[2-(ethylamino)-2-oxo-1-[2-(1-pyrrolidinyl)phenyl]ethyl]benzoic acid IUPAC Name: 4-[2-(ethylamino)-2-oxo-1-(2-pyrrolidin-1-ylphenyl)ethyl]benzoic acid Traditional Name: 4-[2-(ethylamino)-2-keto-1-(2-pyrrolidinophenyl)ethyl]benzoic acid Formula: C21H24N2O3 MolecularWeight: 352.42686

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C1=CC=C(C=C1)C(=O)O)C2=CC=CC=C2N3CCCC3

Isomeric SMILES

CCNC(=O)C(C1=CC=C(C=C1)C(=O)O)C2=CC=CC=C2N3CCCC3

InChI

InChI=1S/C21H24N2O3/c1-2-22-20(24)19(15-9-11-16(12-10-15)21(25)26)17-7-3-4-8-18(17)23-13-5-6-14-23/h3-4,7-12,19H,2,5-6,13-14H2,1H3,(H,22,24)(H,25,26)