methyl 3-(5-phenylmethoxypentyl)-6-propan-2-yl-azulene-1-carboxylate

Systemtic Name: methyl 3-(5-phenylmethoxypentyl)-6-propan-2-yl-azulene-1-carboxylate Openeye Name: methyl 3-(5-benzyloxypentyl)-6-isopropyl-azulene-1-carboxylate CAS Name: 3-(5-phenylmethoxypentyl)-6-propan-2-yl-1-azulenecarboxylic acid methyl ester IUPAC Name: methyl 3-(5-phenylmethoxypentyl)-6-propan-2-ylazulene-1-carboxylate Traditional Name: 3-(5-benzoxypentyl)-6-isopropyl-azulene-1-carboxylic acid methyl ester Formula: C27H32O3 MolecularWeight: 404.54118

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C2C(=C(C=C2CCCCCOCC3=CC=CC=C3)C(=O)OC)C=C1

Isomeric SMILES

CC(C)C1=CC=C2C(=C(C=C2CCCCCOCC3=CC=CC=C3)C(=O)OC)C=C1

InChI

InChI=1S/C27H32O3/c1-20(2)22-13-15-24-23(18-26(27(28)29-3)25(24)16-14-22)12-8-5-9-17-30-19-21-10-6-4-7-11-21/h4,6-7,10-11,13-16,18,20H,5,8-9,12,17,19H2,1-3H3