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

Systemtic Name: methyl 3-(7-phenylmethoxyheptyl)-7-propan-2-yl-azulene-1-carboxylate Openeye Name: methyl 3-(7-benzyloxyheptyl)-7-isopropyl-azulene-1-carboxylate CAS Name: 3-(7-phenylmethoxyheptyl)-7-propan-2-yl-1-azulenecarboxylic acid methyl ester IUPAC Name: methyl 3-(7-phenylmethoxyheptyl)-7-propan-2-ylazulene-1-carboxylate Traditional Name: 3-(7-benzoxyheptyl)-7-isopropyl-azulene-1-carboxylic acid methyl ester Formula: C29H36O3 MolecularWeight: 432.59434

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC2=C(C=C(C2=C1)C(=O)OC)CCCCCCCOCC3=CC=CC=C3

Isomeric SMILES

CC(C)C1=CC=CC2=C(C=C(C2=C1)C(=O)OC)CCCCCCCOCC3=CC=CC=C3

InChI

InChI=1S/C29H36O3/c1-22(2)24-16-12-17-26-25(20-28(27(26)19-24)29(30)31-3)15-10-5-4-6-11-18-32-21-23-13-8-7-9-14-23/h7-9,12-14,16-17,19-20,22H,4-6,10-11,15,18,21H2,1-3H3