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methyl 3-(6-phenylmethoxyhexyl)azulene-1-carboxylate

methyl 3-(6-phenylmethoxyhexyl)azulene-1-carboxylate

Systemtic Name:methyl 3-(6-phenylmethoxyhexyl)azulene-1-carboxylate
Openeye Name:methyl 3-(6-benzyloxyhexyl)azulene-1-carboxylate
CAS Name:3-(6-phenylmethoxyhexyl)-1-azulenecarboxylic acid methyl ester
IUPAC Name:methyl 3-(6-phenylmethoxyhexyl)azulene-1-carboxylate
Traditional Name:3-(6-benzoxyhexyl)azulene-1-carboxylic acid methyl ester
Formula: C25H28O3
MolecularWeight: 376.48802
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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C2C1=CC=CC=C2)CCCCCCOCC3=CC=CC=C3


Isomeric SMILES

COC(=O)C1=CC(=C2C1=CC=CC=C2)CCCCCCOCC3=CC=CC=C3


InChI

InChI=1S/C25H28O3/c1-27-25(26)24-18-21(22-15-9-5-10-16-23(22)24)14-8-2-3-11-17-28-19-20-12-6-4-7-13-20/h4-7,9-10,12-13,15-16,18H,2-3,8,11,14,17,19H2,1H3


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