2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid hydrate

Systemtic Name: 2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid hydrate Openeye Name: 2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid hydrate CAS Name: 2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid hydrate IUPAC Name: 2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid hydrate Traditional Name: 2,3,4,9-tetrahydro-1H-$b-carboline-3-carboxylic acid hydrate Formula: C12H14N2O3 MolecularWeight: 234.25116

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NCC2=C1C3=CC=CC=C3N2)C(=O)O.O

Isomeric SMILES

C1C(NCC2=C1C3=CC=CC=C3N2)C(=O)O.O

InChI

InChI=1S/C12H12N2O2.H2O/c15-12(16)10-5-8-7-3-1-2-4-9(7)14-11(8)6-13-10;/h1-4,10,13-14H,5-6H2,(H,15,16);1H2