5-methyl-3-oxa-5-azabicyclo[4.3.1]deca-1(10),6,8-trien-4-one; 2-phenylethanoic acid

Systemtic Name: 5-methyl-3-oxa-5-azabicyclo[4.3.1]deca-1(10),6,8-trien-4-one; 2-phenylethanoic acid Openeye Name: 5-methyl-3-oxa-5-azabicyclo[4.3.1]deca-1(10),6,8-trien-4-one; 2-phenylacetic acid CAS Name: 5-methyl-3-oxa-5-azabicyclo[4.3.1]deca-1(10),6,8-trien-4-one; 2-phenylacetic acid IUPAC Name: 5-methyl-3-oxa-5-azabicyclo[4.3.1]deca-1(10),6,8-trien-4-one; 2-phenylacetic acid Traditional Name: 5-methyl-3-oxa-5-azabicyclo[4.3.1]deca-1(10),6,8-trien-4-one; 2-phenylacetic acid Formula: C17H17NO4 MolecularWeight: 299.32118

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC(=C2)COC1=O.C1=CC=C(C=C1)CC(=O)O

Isomeric SMILES

CN1C2=CC=CC(=C2)COC1=O.C1=CC=C(C=C1)CC(=O)O

InChI

InChI=1S/C9H9NO2.C8H8O2/c1-10-8-4-2-3-7(5-8)6-12-9(10)11;9-8(10)6-7-4-2-1-3-5-7/h2-5H,6H2,1H3;1-5H,6H2,(H,9,10)