2-[4-[2-[[(1S)-2-methyl-1-thiophen-2-yl-propyl]amino]-2-oxidanylidene-ethoxy]phenyl]ethanoate

Systemtic Name: 2-[4-[2-[[(1S)-2-methyl-1-thiophen-2-yl-propyl]amino]-2-oxidanylidene-ethoxy]phenyl]ethanoate Openeye Name: 2-[4-[2-[[(1S)-2-methyl-1-(2-thienyl)propyl]amino]-2-oxo-ethoxy]phenyl]acetate CAS Name: 2-[4-[2-[[(1S)-2-methyl-1-thiophen-2-ylpropyl]amino]-2-oxoethoxy]phenyl]acetate IUPAC Name: 2-[4-[2-[[(1S)-2-methyl-1-thiophen-2-ylpropyl]amino]-2-oxoethoxy]phenyl]acetate Traditional Name: 2-[4-[2-keto-2-[[(1S)-2-methyl-1-(2-thienyl)propyl]amino]ethoxy]phenyl]acetate Formula: C18H20NO4S- MolecularWeight: 346.4207

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=CS1)NC(=O)COC2=CC=C(C=C2)CC(=O)[O-]

Isomeric SMILES

CC(C)[C@@H](C1=CC=CS1)NC(=O)COC2=CC=C(C=C2)CC(=O)[O-]

InChI

InChI=1S/C18H21NO4S/c1-12(2)18(15-4-3-9-24-15)19-16(20)11-23-14-7-5-13(6-8-14)10-17(21)22/h3-9,12,18H,10-11H2,1-2H3,(H,19,20)(H,21,22)/p-1/t18-/m0/s1