2-oxidanylpropanedioic acid; 3-propyl-7-azabicyclo[2.2.1]hepta-1,3,5-triene

Systemtic Name: 2-oxidanylpropanedioic acid; 3-propyl-7-azabicyclo[2.2.1]hepta-1,3,5-triene Openeye Name: 2-hydroxypropanedioic acid; 3-propyl-7-azabicyclo[2.2.1]hepta-1,3,5-triene CAS Name: 2-hydroxypropanedioic acid; 3-propyl-7-azabicyclo[2.2.1]hepta-1,3,5-triene IUPAC Name: 2-hydroxypropanedioic acid; 3-propyl-7-azabicyclo[2.2.1]hepta-1,3,5-triene Traditional Name: 2-hydroxymalonic acid; 3-propyl-7-azabicyclo[2.2.1]hepta-1,3,5-triene Formula: C12H15NO5 MolecularWeight: 253.2512

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2C=CC(=C1)N2.C(C(=O)O)(C(=O)O)O

Isomeric SMILES

CCCC1=C2C=CC(=C1)N2.C(C(=O)O)(C(=O)O)O

InChI

InChI=1S/C9H11N.C3H4O5/c1-2-3-7-6-8-4-5-9(7)10-8;4-1(2(5)6)3(7)8/h4-6,10H,2-3H2,1H3;1,4H,(H,5,6)(H,7,8)