propyl (4S,4aS,7S)-2-methyl-4-(5-methylfuran-2-yl)-5-oxidanylidene-7-thiophen-2-yl-4,4a,6,7-tetrahydro-3H-quinoline-3-carboxylate

Systemtic Name: propyl (4S,4aS,7S)-2-methyl-4-(5-methylfuran-2-yl)-5-oxidanylidene-7-thiophen-2-yl-4,4a,6,7-tetrahydro-3H-quinoline-3-carboxylate Openeye Name: propyl (4S,4aS,7S)-2-methyl-4-(5-methyl-2-furyl)-5-oxo-7-(2-thienyl)-4,4a,6,7-tetrahydro-3H-quinoline-3-carboxylate CAS Name: (4S,4aS,7S)-2-methyl-4-(5-methyl-2-furanyl)-5-oxo-7-thiophen-2-yl-4,4a,6,7-tetrahydro-3H-quinoline-3-carboxylic acid propyl ester IUPAC Name: propyl (4S,4aS,7S)-2-methyl-4-(5-methylfuran-2-yl)-5-oxo-7-thiophen-2-yl-4,4a,6,7-tetrahydro-3H-quinoline-3-carboxylate Traditional Name: (4S,4aS,7S)-5-keto-2-methyl-4-(5-methyl-2-furyl)-7-(2-thienyl)-4,4a,6,7-tetrahydro-3H-quinoline-3-carboxylic acid propyl ester Formula: C23H25NO4S MolecularWeight: 411.5139

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1C(C2C(=O)CC(C=C2N=C1C)C3=CC=CS3)C4=CC=C(O4)C

Isomeric SMILES

CCCOC(=O)C1[C@H]([C@@H]2C(=O)C[C@@H](C=C2N=C1C)C3=CC=CS3)C4=CC=C(O4)C

InChI

InChI=1S/C23H25NO4S/c1-4-9-27-23(26)20-14(3)24-16-11-15(19-6-5-10-29-19)12-17(25)21(16)22(20)18-8-7-13(2)28-18/h5-8,10-11,15,20-22H,4,9,12H2,1-3H3/t15-,20?,21+,22-/m1/s1