methyl 3-(5-oxidanylpentyl)-7-propan-2-yl-azulene-1-carboxylate

Systemtic Name: methyl 3-(5-oxidanylpentyl)-7-propan-2-yl-azulene-1-carboxylate Openeye Name: methyl 3-(5-hydroxypentyl)-7-isopropyl-azulene-1-carboxylate CAS Name: 3-(5-hydroxypentyl)-7-propan-2-yl-1-azulenecarboxylic acid methyl ester IUPAC Name: methyl 3-(5-hydroxypentyl)-7-propan-2-ylazulene-1-carboxylate Traditional Name: 3-(5-hydroxypentyl)-7-isopropyl-azulene-1-carboxylic acid methyl ester Formula: C20H26O3 MolecularWeight: 314.41864

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC2=C(C=C(C2=C1)C(=O)OC)CCCCCO

Isomeric SMILES

CC(C)C1=CC=CC2=C(C=C(C2=C1)C(=O)OC)CCCCCO

InChI

InChI=1S/C20H26O3/c1-14(2)15-9-7-10-17-16(8-5-4-6-11-21)13-19(18(17)12-15)20(22)23-3/h7,9-10,12-14,21H,4-6,8,11H2,1-3H3