5-pentan-3-yloxy-7-(phenylmethyl)-7-azabicyclo[4.1.0]hept-3-ene-3-carboxylic acid

Systemtic Name: 5-pentan-3-yloxy-7-(phenylmethyl)-7-azabicyclo[4.1.0]hept-3-ene-3-carboxylic acid Openeye Name: 7-benzyl-5-(1-ethylpropoxy)-7-azabicyclo[4.1.0]hept-3-ene-3-carboxylic acid CAS Name: 5-pentan-3-yloxy-7-(phenylmethyl)-7-azabicyclo[4.1.0]hept-3-ene-3-carboxylic acid IUPAC Name: 7-benzyl-5-pentan-3-yloxy-7-azabicyclo[4.1.0]hept-3-ene-3-carboxylic acid Traditional Name: 7-benzyl-5-(1-ethylpropoxy)-7-azabicyclo[4.1.0]hept-3-ene-3-carboxylic acid Formula: C19H25NO3 MolecularWeight: 315.4067

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)OC1C=C(CC2C1N2CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CCC(CC)OC1C=C(CC2C1N2CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C19H25NO3/c1-3-15(4-2)23-17-11-14(19(21)22)10-16-18(17)20(16)12-13-8-6-5-7-9-13/h5-9,11,15-18H,3-4,10,12H2,1-2H3,(H,21,22)