methyl 3-[3-(phenylmethoxymethyl)phenyl]-6-propan-2-yl-azulene-1-carboxylate

Systemtic Name: methyl 3-[3-(phenylmethoxymethyl)phenyl]-6-propan-2-yl-azulene-1-carboxylate Openeye Name: methyl 3-[3-(benzyloxymethyl)phenyl]-6-isopropyl-azulene-1-carboxylate CAS Name: 3-[3-(phenylmethoxymethyl)phenyl]-6-propan-2-yl-1-azulenecarboxylic acid methyl ester IUPAC Name: methyl 3-[3-(phenylmethoxymethyl)phenyl]-6-propan-2-ylazulene-1-carboxylate Traditional Name: 3-[3-(benzoxymethyl)phenyl]-6-isopropyl-azulene-1-carboxylic acid methyl ester Formula: C29H28O3 MolecularWeight: 424.53082

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C2C(=C(C=C2C(=O)OC)C3=CC(=CC=C3)COCC4=CC=CC=C4)C=C1

Isomeric SMILES

CC(C)C1=CC=C2C(=C(C=C2C(=O)OC)C3=CC(=CC=C3)COCC4=CC=CC=C4)C=C1

InChI

InChI=1S/C29H28O3/c1-20(2)23-12-14-25-26(15-13-23)28(29(30)31-3)17-27(25)24-11-7-10-22(16-24)19-32-18-21-8-5-4-6-9-21/h4-17,20H,18-19H2,1-3H3