2-methyloxirane; 2-nonyl-6-oxidanyl-benzaldehyde; oxirane

Systemtic Name: 2-methyloxirane; 2-nonyl-6-oxidanyl-benzaldehyde; oxirane Openeye Name: 2-hydroxy-6-nonyl-benzaldehyde; 2-methyloxirane; oxirane CAS Name: 2-hydroxy-6-nonylbenzaldehyde; 2-methyloxirane; oxirane IUPAC Name: 2-hydroxy-6-nonylbenzaldehyde; 2-methyloxirane; oxirane Traditional Name: ethylene oxide; 2-hydroxy-6-nonyl-benzaldehyde; propylene oxide Formula: C21H34O4 MolecularWeight: 350.49226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=C(C(=CC=C1)O)C=O.CC1CO1.C1CO1

Isomeric SMILES

CCCCCCCCCC1=C(C(=CC=C1)O)C=O.CC1CO1.C1CO1

InChI

InChI=1S/C16H24O2.C3H6O.C2H4O/c1-2-3-4-5-6-7-8-10-14-11-9-12-16(18)15(14)13-17;1-3-2-4-3;1-2-3-1/h9,11-13,18H,2-8,10H2,1H3;3H,2H2,1H3;1-2H2