methyl 3-(6-phenylmethoxyhexyl)-7-propan-2-yl-azulene-1-carboxylate

Systemtic Name: methyl 3-(6-phenylmethoxyhexyl)-7-propan-2-yl-azulene-1-carboxylate Openeye Name: methyl 3-(6-benzyloxyhexyl)-7-isopropyl-azulene-1-carboxylate CAS Name: 3-(6-phenylmethoxyhexyl)-7-propan-2-yl-1-azulenecarboxylic acid methyl ester IUPAC Name: methyl 3-(6-phenylmethoxyhexyl)-7-propan-2-ylazulene-1-carboxylate Traditional Name: 3-(6-benzoxyhexyl)-7-isopropyl-azulene-1-carboxylic acid methyl ester Formula: C28H34O3 MolecularWeight: 418.56776

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC2=C(C=C(C2=C1)C(=O)OC)CCCCCCOCC3=CC=CC=C3

Isomeric SMILES

CC(C)C1=CC=CC2=C(C=C(C2=C1)C(=O)OC)CCCCCCOCC3=CC=CC=C3

InChI

InChI=1S/C28H34O3/c1-21(2)23-15-11-16-25-24(19-27(26(25)18-23)28(29)30-3)14-9-4-5-10-17-31-20-22-12-7-6-8-13-22/h6-8,11-13,15-16,18-19,21H,4-5,9-10,14,17,20H2,1-3H3