1-methyl-3,4,9,9a-tetrahydropyrido[3,4-b]indol-7-one hydrate hydrochloride

Systemtic Name: 1-methyl-3,4,9,9a-tetrahydropyrido[3,4-b]indol-7-one hydrate hydrochloride Openeye Name: 1-methyl-3,4,9,9a-tetrahydropyrido[3,4-b]indol-7-one hydrate hydrochloride CAS Name: 1-methyl-3,4,9,9a-tetrahydropyrido[3,4-b]indol-7-one hydrate hydrochloride IUPAC Name: 1-methyl-3,4,9,9a-tetrahydropyrido[3,4-b]indol-7-one hydrate hydrochloride Traditional Name: 1-methyl-3,4,9,9a-tetrahydro-$b-carbolin-7-one hydrate hydrochloride Formula: C12H15ClN2O2 MolecularWeight: 254.7127

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NCCC2=C3C=CC(=O)C=C3NC12.O.Cl

Isomeric SMILES

CC1=NCCC2=C3C=CC(=O)C=C3NC12.O.Cl

InChI

InChI=1S/C12H12N2O.ClH.H2O/c1-7-12-10(4-5-13-7)9-3-2-8(15)6-11(9)14-12;;/h2-3,6,12,14H,4-5H2,1H3;1H;1H2