9-cyclohexyl-9-phenyl-non-4-yne-1,9-diol; nitrosomethane

Systemtic Name: 9-cyclohexyl-9-phenyl-non-4-yne-1,9-diol; nitrosomethane Openeye Name: 9-cyclohexyl-9-phenyl-non-4-yne-1,9-diol; nitrosomethane CAS Name: 9-cyclohexyl-9-phenyl-4-nonyne-1,9-diol; nitrosomethane IUPAC Name: 9-cyclohexyl-9-phenylnon-4-yne-1,9-diol; nitrosomethane Traditional Name: 9-cyclohexyl-9-phenyl-non-4-yne-1,9-diol; nitrosomethane Formula: C22H33NO3 MolecularWeight: 359.50232

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Descriptors Computed from Structure

Canonical SMILES:

CN=O.C1CCC(CC1)C(CCCC#CCCCO)(C2=CC=CC=C2)O

Isomeric SMILES

CN=O.C1CCC(CC1)C(CCCC#CCCCO)(C2=CC=CC=C2)O

InChI

InChI=1S/C21H30O2.CH3NO/c22-18-12-4-2-1-3-11-17-21(23,19-13-7-5-8-14-19)20-15-9-6-10-16-20;1-2-3/h5,7-8,13-14,20,22-23H,3-4,6,9-12,15-18H2;1H3