2-(3-azanylpropyl)phenol; (2S,3S)-2,3-bis(oxidanyl)butanedioic acid

Systemtic Name: 2-(3-azanylpropyl)phenol; (2S,3S)-2,3-bis(oxidanyl)butanedioic acid Openeye Name: 2-(3-aminopropyl)phenol; (2S,3S)-2,3-dihydroxybutanedioic acid CAS Name: 2-(3-aminopropyl)phenol; (2S,3S)-2,3-dihydroxybutanedioic acid IUPAC Name: 2-(3-aminopropyl)phenol; (2S,3S)-2,3-dihydroxybutanedioic acid Traditional Name: 2-(3-aminopropyl)phenol; (2S,3S)-2,3-dihydroxysuccinic acid Formula: C13H19NO7 MolecularWeight: 301.29246

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CCCN)O.C(C(C(=O)O)O)(C(=O)O)O

Isomeric SMILES

C1=CC=C(C(=C1)CCCN)O.[C@H]([C@@H](C(=O)O)O)(C(=O)O)O

InChI

InChI=1S/C9H13NO.C4H6O6/c10-7-3-5-8-4-1-2-6-9(8)11;5-1(3(7)8)2(6)4(9)10/h1-2,4,6,11H,3,5,7,10H2;1-2,5-6H,(H,7,8)(H,9,10)/t;1-,2-/m.0/s1