3-[4-[2-(cyclopropylmethylamino)-2-oxidanylidene-ethyl]phenyl]benzoic acid

Systemtic Name: 3-[4-[2-(cyclopropylmethylamino)-2-oxidanylidene-ethyl]phenyl]benzoic acid Openeye Name: 3-[4-[2-(cyclopropylmethylamino)-2-oxo-ethyl]phenyl]benzoic acid CAS Name: 3-[4-[2-(cyclopropylmethylamino)-2-oxoethyl]phenyl]benzoic acid IUPAC Name: 3-[4-[2-(cyclopropylmethylamino)-2-oxoethyl]phenyl]benzoic acid Traditional Name: 3-[4-[2-(cyclopropylmethylamino)-2-keto-ethyl]phenyl]benzoic acid Formula: C19H19NO3 MolecularWeight: 309.35906

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CNC(=O)CC2=CC=C(C=C2)C3=CC(=CC=C3)C(=O)O

Isomeric SMILES

C1CC1CNC(=O)CC2=CC=C(C=C2)C3=CC(=CC=C3)C(=O)O

InChI

InChI=1S/C19H19NO3/c21-18(20-12-14-4-5-14)10-13-6-8-15(9-7-13)16-2-1-3-17(11-16)19(22)23/h1-3,6-9,11,14H,4-5,10,12H2,(H,20,21)(H,22,23)