methyl 4-[2-(1-methyl-7-propan-2-yl-azulen-4-yl)-1-oxidanyl-ethyl]benzoate

Systemtic Name: methyl 4-[2-(1-methyl-7-propan-2-yl-azulen-4-yl)-1-oxidanyl-ethyl]benzoate Openeye Name: methyl 4-[1-hydroxy-2-(7-isopropyl-1-methyl-azulen-4-yl)ethyl]benzoate CAS Name: 4-[1-hydroxy-2-(1-methyl-7-propan-2-yl-4-azulenyl)ethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[1-hydroxy-2-(1-methyl-7-propan-2-ylazulen-4-yl)ethyl]benzoate Traditional Name: 4-[1-hydroxy-2-(7-isopropyl-1-methyl-azulen-4-yl)ethyl]benzoic acid methyl ester Formula: C24H26O3 MolecularWeight: 362.46144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(C=CC(=C2C=C1)CC(C3=CC=C(C=C3)C(=O)OC)O)C(C)C

Isomeric SMILES

CC1=C2C=C(C=CC(=C2C=C1)CC(C3=CC=C(C=C3)C(=O)OC)O)C(C)C

InChI

InChI=1S/C24H26O3/c1-15(2)19-10-11-20(21-12-5-16(3)22(21)13-19)14-23(25)17-6-8-18(9-7-17)24(26)27-4/h5-13,15,23,25H,14H2,1-4H3