2-dimethylaminoethyl 4-(4-hexylphenyl)carbonylbenzoate

Systemtic Name: 2-dimethylaminoethyl 4-(4-hexylphenyl)carbonylbenzoate Openeye Name: 2-dimethylaminoethyl 4-(4-hexylbenzoyl)benzoate CAS Name: 4-[(4-hexylphenyl)-oxomethyl]benzoic acid 2-dimethylaminoethyl ester IUPAC Name: 2-dimethylaminoethyl 4-(4-hexylbenzoyl)benzoate Traditional Name: 4-(4-hexylbenzoyl)benzoic acid 2-dimethylaminoethyl ester Formula: C24H31NO3 MolecularWeight: 381.50784

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)C(=O)OCCN(C)C

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)C(=O)OCCN(C)C

InChI

InChI=1S/C24H31NO3/c1-4-5-6-7-8-19-9-11-20(12-10-19)23(26)21-13-15-22(16-14-21)24(27)28-18-17-25(2)3/h9-16H,4-8,17-18H2,1-3H3