butyl (4S,7R)-4-(furan-2-yl)-2-methyl-5-oxidanylidene-7-phenyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate

Systemtic Name: butyl (4S,7R)-4-(furan-2-yl)-2-methyl-5-oxidanylidene-7-phenyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate Openeye Name: butyl (4S,7R)-4-(2-furyl)-2-methyl-5-oxo-7-phenyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate CAS Name: (4S,7R)-4-(2-furanyl)-2-methyl-5-oxo-7-phenyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid butyl ester IUPAC Name: butyl (4S,7R)-4-(furan-2-yl)-2-methyl-5-oxo-7-phenyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate Traditional Name: (4S,7R)-4-(2-furyl)-5-keto-2-methyl-7-phenyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid butyl ester Formula: C25H27NO4 MolecularWeight: 405.48618

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=C(NC2=C(C1C3=CC=CO3)C(=O)CC(C2)C4=CC=CC=C4)C

Isomeric SMILES

CCCCOC(=O)C1=C(NC2=C([C@@H]1C3=CC=CO3)C(=O)C[C@@H](C2)C4=CC=CC=C4)C

InChI

InChI=1S/C25H27NO4/c1-3-4-12-30-25(28)22-16(2)26-19-14-18(17-9-6-5-7-10-17)15-20(27)23(19)24(22)21-11-8-13-29-21/h5-11,13,18,24,26H,3-4,12,14-15H2,1-2H3/t18-,24-/m1/s1