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

Systemtic Name: methyl 3-(3-phenylmethoxypropyl)-7-propan-2-yl-azulene-1-carboxylate Openeye Name: methyl 3-(3-benzyloxypropyl)-7-isopropyl-azulene-1-carboxylate CAS Name: 3-(3-phenylmethoxypropyl)-7-propan-2-yl-1-azulenecarboxylic acid methyl ester IUPAC Name: methyl 3-(3-phenylmethoxypropyl)-7-propan-2-ylazulene-1-carboxylate Traditional Name: 3-(3-benzoxypropyl)-7-isopropyl-azulene-1-carboxylic acid methyl ester Formula: C25H28O3 MolecularWeight: 376.48802

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC2=C(C=C(C2=C1)C(=O)OC)CCCOCC3=CC=CC=C3

Isomeric SMILES

CC(C)C1=CC=CC2=C(C=C(C2=C1)C(=O)OC)CCCOCC3=CC=CC=C3

InChI

InChI=1S/C25H28O3/c1-18(2)20-11-7-13-22-21(16-24(23(22)15-20)25(26)27-3)12-8-14-28-17-19-9-5-4-6-10-19/h4-7,9-11,13,15-16,18H,8,12,14,17H2,1-3H3