methyl (3S,4R)-4-(5-ethylthiophen-2-yl)-2-methyl-5-oxidanylidene-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate

Systemtic Name: methyl (3S,4R)-4-(5-ethylthiophen-2-yl)-2-methyl-5-oxidanylidene-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate Openeye Name: methyl (3S,4R)-4-(5-ethyl-2-thienyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate CAS Name: (3S,4R)-4-(5-ethyl-2-thiophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylic acid methyl ester IUPAC Name: methyl (3S,4R)-4-(5-ethylthiophen-2-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate Traditional Name: (3S,4R)-4-(5-ethyl-2-thienyl)-5-keto-2-methyl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylic acid methyl ester Formula: C18H21NO3S MolecularWeight: 331.42924

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)C2C(C(=NC3=C2C(=O)CCC3)C)C(=O)OC

Isomeric SMILES

CCC1=CC=C(S1)[C@@H]2[C@@H](C(=NC3=C2C(=O)CCC3)C)C(=O)OC

InChI

InChI=1S/C18H21NO3S/c1-4-11-8-9-14(23-11)17-15(18(21)22-3)10(2)19-12-6-5-7-13(20)16(12)17/h8-9,15,17H,4-7H2,1-3H3/t15-,17-/m1/s1