7-(7-chloranylindol-1-yl)-2,2-dimethyl-4-(1,2,4-triazol-1-yl)heptan-3-ol

Systemtic Name: 7-(7-chloranylindol-1-yl)-2,2-dimethyl-4-(1,2,4-triazol-1-yl)heptan-3-ol Openeye Name: 7-(7-chloroindol-1-yl)-2,2-dimethyl-4-(1,2,4-triazol-1-yl)heptan-3-ol CAS Name: 7-(7-chloro-1-indolyl)-2,2-dimethyl-4-(1,2,4-triazol-1-yl)-3-heptanol IUPAC Name: 7-(7-chloroindol-1-yl)-2,2-dimethyl-4-(1,2,4-triazol-1-yl)heptan-3-ol Traditional Name: 7-(7-chloroindol-1-yl)-2,2-dimethyl-4-(1,2,4-triazol-1-yl)heptan-3-ol Formula: C19H25ClN4O MolecularWeight: 360.881

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(CCCN1C=CC2=C1C(=CC=C2)Cl)N3C=NC=N3)O

Isomeric SMILES

CC(C)(C)C(C(CCCN1C=CC2=C1C(=CC=C2)Cl)N3C=NC=N3)O

InChI

InChI=1S/C19H25ClN4O/c1-19(2,3)18(25)16(24-13-21-12-22-24)8-5-10-23-11-9-14-6-4-7-15(20)17(14)23/h4,6-7,9,11-13,16,18,25H,5,8,10H2,1-3H3