3-[(1S)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium-1-yl]phenol

Systemtic Name: 3-[(1S)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium-1-yl]phenol Openeye Name: 3-[(1S)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium-1-yl]phenol CAS Name: 3-[(1S)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium-1-yl]phenol IUPAC Name: 3-[(1S)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium-1-yl]phenol Traditional Name: 3-[(1S)-2,3,4,9-tetrahydro-1H-$b-carbolin-2-ium-1-yl]phenol Formula: C17H17N2O+ MolecularWeight: 265.32968

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]C(C2=C1C3=CC=CC=C3N2)C4=CC(=CC=C4)O

Isomeric SMILES

C1C[NH2+][C@H](C2=C1C3=CC=CC=C3N2)C4=CC(=CC=C4)O

InChI

InChI=1S/C17H16N2O/c20-12-5-3-4-11(10-12)16-17-14(8-9-18-16)13-6-1-2-7-15(13)19-17/h1-7,10,16,18-20H,8-9H2/p+1/t16-/m0/s1