[2-oxidanylidene-2-[[(1R)-1-thiophen-2-ylethyl]amino]ethyl] 4-butoxybenzoate

Systemtic Name: [2-oxidanylidene-2-[[(1R)-1-thiophen-2-ylethyl]amino]ethyl] 4-butoxybenzoate Openeye Name: [2-oxo-2-[[(1R)-1-(2-thienyl)ethyl]amino]ethyl] 4-butoxybenzoate CAS Name: 4-butoxybenzoic acid [2-oxo-2-[[(1R)-1-thiophen-2-ylethyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-[[(1R)-1-thiophen-2-ylethyl]amino]ethyl] 4-butoxybenzoate Traditional Name: 4-butoxybenzoic acid [2-keto-2-[[(1R)-1-(2-thienyl)ethyl]amino]ethyl] ester Formula: C19H23NO4S MolecularWeight: 361.45522

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)OCC(=O)NC(C)C2=CC=CS2

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)OCC(=O)N[C@H](C)C2=CC=CS2

InChI

InChI=1S/C19H23NO4S/c1-3-4-11-23-16-9-7-15(8-10-16)19(22)24-13-18(21)20-14(2)17-6-5-12-25-17/h5-10,12,14H,3-4,11,13H2,1-2H3,(H,20,21)/t14-/m1/s1