2-[5-(2-methyl-2-morpholin-4-yl-propanoyl)thiophen-3-yl]ethyl benzoate

Systemtic Name: 2-[5-(2-methyl-2-morpholin-4-yl-propanoyl)thiophen-3-yl]ethyl benzoate Openeye Name: 2-[5-(2-methyl-2-morpholino-propanoyl)-3-thienyl]ethyl benzoate CAS Name: benzoic acid 2-[5-[2-methyl-2-(4-morpholinyl)-1-oxopropyl]-3-thiophenyl]ethyl ester IUPAC Name: 2-[5-(2-methyl-2-morpholin-4-ylpropanoyl)thiophen-3-yl]ethyl benzoate Traditional Name: benzoic acid 2-[5-(2-methyl-2-morpholino-propanoyl)-3-thienyl]ethyl ester Formula: C21H25NO4S MolecularWeight: 387.4925

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)C1=CC(=CS1)CCOC(=O)C2=CC=CC=C2)N3CCOCC3

Isomeric SMILES

CC(C)(C(=O)C1=CC(=CS1)CCOC(=O)C2=CC=CC=C2)N3CCOCC3

InChI

InChI=1S/C21H25NO4S/c1-21(2,22-9-12-25-13-10-22)19(23)18-14-16(15-27-18)8-11-26-20(24)17-6-4-3-5-7-17/h3-7,14-15H,8-13H2,1-2H3