(4-phenylbutylamino) 4-pyridin-2-ylbenzoate

Systemtic Name: (4-phenylbutylamino) 4-pyridin-2-ylbenzoate Openeye Name: (4-phenylbutylamino) 4-(2-pyridyl)benzoate CAS Name: 4-(2-pyridinyl)benzoic acid (4-phenylbutylamino) ester IUPAC Name: (4-phenylbutylamino) 4-pyridin-2-ylbenzoate Traditional Name: 4-(2-pyridyl)benzoic acid (4-phenylbutylamino) ester Formula: C22H22N2O2 MolecularWeight: 346.42228

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCNOC(=O)C2=CC=C(C=C2)C3=CC=CC=N3

Isomeric SMILES

C1=CC=C(C=C1)CCCCNOC(=O)C2=CC=C(C=C2)C3=CC=CC=N3

InChI

InChI=1S/C22H22N2O2/c25-22(26-24-17-7-4-10-18-8-2-1-3-9-18)20-14-12-19(13-15-20)21-11-5-6-16-23-21/h1-3,5-6,8-9,11-16,24H,4,7,10,17H2