nonan-3-yl 3,5-dimethylbenzoate hydrochloride

Systemtic Name: nonan-3-yl 3,5-dimethylbenzoate hydrochloride Openeye Name: 1-ethylheptyl 3,5-dimethylbenzoate hydrochloride CAS Name: 3,5-dimethylbenzoic acid nonan-3-yl ester hydrochloride IUPAC Name: nonan-3-yl 3,5-dimethylbenzoate hydrochloride Traditional Name: 3,5-dimethylbenzoic acid 1-ethylheptyl ester hydrochloride Formula: C18H29ClO2 MolecularWeight: 312.87466

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CC)OC(=O)C1=CC(=CC(=C1)C)C.Cl

Isomeric SMILES

CCCCCCC(CC)OC(=O)C1=CC(=CC(=C1)C)C.Cl

InChI

InChI=1S/C18H28O2.ClH/c1-5-7-8-9-10-17(6-2)20-18(19)16-12-14(3)11-15(4)13-16;/h11-13,17H,5-10H2,1-4H3;1H