methyl 3-methyl-2-[(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbonylamino]butanoate

Systemtic Name: methyl 3-methyl-2-[(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbonylamino]butanoate Openeye Name: methyl 3-methyl-2-[(5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl)amino]butanoate CAS Name: 3-methyl-2-[[(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-oxomethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 3-methyl-2-[(5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbonyl)amino]butanoate Traditional Name: 3-methyl-2-[(5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl)amino]butyric acid methyl ester Formula: C16H23NO3S MolecularWeight: 309.42372

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(S2)C(=O)NC(C(C)C)C(=O)OC

Isomeric SMILES

CC1CCC2=C(C1)C=C(S2)C(=O)NC(C(C)C)C(=O)OC

InChI

InChI=1S/C16H23NO3S/c1-9(2)14(16(19)20-4)17-15(18)13-8-11-7-10(3)5-6-12(11)21-13/h8-10,14H,5-7H2,1-4H3,(H,17,18)