3-(2-chloranyl-6-nitro-phenyl)-1,1-di(cyclobutyl)prop-2-yn-1-ol

Systemtic Name: 3-(2-chloranyl-6-nitro-phenyl)-1,1-di(cyclobutyl)prop-2-yn-1-ol Openeye Name: 3-(2-chloro-6-nitro-phenyl)-1,1-di(cyclobutyl)prop-2-yn-1-ol CAS Name: 3-(2-chloro-6-nitrophenyl)-1,1-di(cyclobutyl)-2-propyn-1-ol IUPAC Name: 3-(2-chloro-6-nitrophenyl)-1,1-di(cyclobutyl)prop-2-yn-1-ol Traditional Name: 3-(2-chloro-6-nitro-phenyl)-1,1-di(cyclobutyl)prop-2-yn-1-ol Formula: C17H18ClNO3 MolecularWeight: 319.78272

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)C(C#CC2=C(C=CC=C2Cl)[N+](=O)[O-])(C3CCC3)O

Isomeric SMILES

C1CC(C1)C(C#CC2=C(C=CC=C2Cl)[N+](=O)[O-])(C3CCC3)O

InChI

InChI=1S/C17H18ClNO3/c18-15-8-3-9-16(19(21)22)14(15)10-11-17(20,12-4-1-5-12)13-6-2-7-13/h3,8-9,12-13,20H,1-2,4-7H2