[(1S,4S)-1,3-dicarboxy-4-(4-hydroxyphenyl)cyclopent-2-en-1-yl]azanium

Systemtic Name: [(1S,4S)-1,3-dicarboxy-4-(4-hydroxyphenyl)cyclopent-2-en-1-yl]azanium Openeye Name: [(1S,4S)-1,3-dicarboxy-4-(4-hydroxyphenyl)cyclopent-2-en-1-yl]ammonium CAS Name: [(1S,4S)-1,3-dicarboxy-4-(4-hydroxyphenyl)-1-cyclopent-2-enyl]ammonium IUPAC Name: [(1S,4S)-1,3-dicarboxy-4-(4-hydroxyphenyl)cyclopent-2-en-1-yl]azanium Traditional Name: [(1S,4S)-1,3-dicarboxy-4-(4-hydroxyphenyl)cyclopent-2-en-1-yl]ammonium Formula: C13H14NO5+ MolecularWeight: 264.25396

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=CC1(C(=O)O)[NH3+])C(=O)O)C2=CC=C(C=C2)O

Isomeric SMILES

C1[C@H](C(=C[C@@]1(C(=O)O)[NH3+])C(=O)O)C2=CC=C(C=C2)O

InChI

InChI=1S/C13H13NO5/c14-13(12(18)19)5-9(10(6-13)11(16)17)7-1-3-8(15)4-2-7/h1-4,6,9,15H,5,14H2,(H,16,17)(H,18,19)/p+1/t9-,13-/m0/s1