methyl 3-phenyl-3-(4,5,6,7-tetrahydro-1-benzothiophen-3-ylcarbonylamino)propanoate

Systemtic Name: methyl 3-phenyl-3-(4,5,6,7-tetrahydro-1-benzothiophen-3-ylcarbonylamino)propanoate Openeye Name: methyl 3-phenyl-3-(4,5,6,7-tetrahydrobenzothiophene-3-carbonylamino)propanoate CAS Name: 3-[[oxo(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 3-phenyl-3-(4,5,6,7-tetrahydro-1-benzothiophene-3-carbonylamino)propanoate Traditional Name: 3-phenyl-3-(4,5,6,7-tetrahydrobenzothiophene-3-carbonylamino)propionic acid methyl ester Formula: C19H21NO3S MolecularWeight: 343.43994

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=CC=C1)NC(=O)C2=CSC3=C2CCCC3

Isomeric SMILES

COC(=O)CC(C1=CC=CC=C1)NC(=O)C2=CSC3=C2CCCC3

InChI

InChI=1S/C19H21NO3S/c1-23-18(21)11-16(13-7-3-2-4-8-13)20-19(22)15-12-24-17-10-6-5-9-14(15)17/h2-4,7-8,12,16H,5-6,9-11H2,1H3,(H,20,22)