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

Systemtic Name: 1-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid hydrate Openeye Name: 1-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid hydrate CAS Name: 1-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid hydrate IUPAC Name: 1-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid hydrate Traditional Name: 1-methyl-2,3,4,9-tetrahydro-1H-$b-carboline-3-carboxylic acid hydrate Formula: C13H16N2O3 MolecularWeight: 248.27774

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=C(CC(N1)C(=O)O)C3=CC=CC=C3N2.O

Isomeric SMILES

CC1C2=C(CC(N1)C(=O)O)C3=CC=CC=C3N2.O

InChI

InChI=1S/C13H14N2O2.H2O/c1-7-12-9(6-11(14-7)13(16)17)8-4-2-3-5-10(8)15-12;/h2-5,7,11,14-15H,6H2,1H3,(H,16,17);1H2