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

Systemtic Name: methyl 3-(6-phenylmethoxyhexyl)-6-propan-2-yl-azulene-1-carboxylate Openeye Name: methyl 3-(6-benzyloxyhexyl)-6-isopropyl-azulene-1-carboxylate CAS Name: 3-(6-phenylmethoxyhexyl)-6-propan-2-yl-1-azulenecarboxylic acid methyl ester IUPAC Name: methyl 3-(6-phenylmethoxyhexyl)-6-propan-2-ylazulene-1-carboxylate Traditional Name: 3-(6-benzoxyhexyl)-6-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=C2C(=C(C=C2CCCCCCOCC3=CC=CC=C3)C(=O)OC)C=C1

Isomeric SMILES

CC(C)C1=CC=C2C(=C(C=C2CCCCCCOCC3=CC=CC=C3)C(=O)OC)C=C1

InChI

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