(2S)-1-(benzotriazol-1-yl)-3-(7-chloranyl-2,3-dimethyl-indol-1-yl)propan-2-ol

Systemtic Name: (2S)-1-(benzotriazol-1-yl)-3-(7-chloranyl-2,3-dimethyl-indol-1-yl)propan-2-ol Openeye Name: (2S)-1-(benzotriazol-1-yl)-3-(7-chloro-2,3-dimethyl-indol-1-yl)propan-2-ol CAS Name: (2S)-1-(1-benzotriazolyl)-3-(7-chloro-2,3-dimethyl-1-indolyl)-2-propanol IUPAC Name: (2S)-1-(benzotriazol-1-yl)-3-(7-chloro-2,3-dimethylindol-1-yl)propan-2-ol Traditional Name: (2S)-1-(benzotriazol-1-yl)-3-(7-chloro-2,3-dimethyl-indol-1-yl)propan-2-ol Formula: C19H19ClN4O MolecularWeight: 354.83336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C1C=CC=C2Cl)CC(CN3C4=CC=CC=C4N=N3)O)C

Isomeric SMILES

CC1=C(N(C2=C1C=CC=C2Cl)C[C@@H](CN3C4=CC=CC=C4N=N3)O)C

InChI

InChI=1S/C19H19ClN4O/c1-12-13(2)23(19-15(12)6-5-7-16(19)20)10-14(25)11-24-18-9-4-3-8-17(18)21-22-24/h3-9,14,25H,10-11H2,1-2H3/t14-/m0/s1