methyl 1-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)carbonyl]pyrrolidine-2-carboxylate

Systemtic Name: methyl 1-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)carbonyl]pyrrolidine-2-carboxylate Openeye Name: methyl 1-(6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carbonyl)pyrrolidine-2-carboxylate CAS Name: 1-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-oxomethyl]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)pyrrolidine-2-carboxylate Traditional Name: 1-(6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carbonyl)pyrrolidine-2-carboxylic acid methyl ester Formula: C16H21NO3S MolecularWeight: 307.40784

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC=C2C(=O)N3CCCC3C(=O)OC

Isomeric SMILES

CC1CCC2=C(C1)SC=C2C(=O)N3CCCC3C(=O)OC

InChI

InChI=1S/C16H21NO3S/c1-10-5-6-11-12(9-21-14(11)8-10)15(18)17-7-3-4-13(17)16(19)20-2/h9-10,13H,3-8H2,1-2H3