2-methoxyethyl (4S,4aR,7R)-2-methyl-5-oxidanylidene-7-phenyl-4-pyridin-3-yl-4,4a,6,7-tetrahydro-3H-quinoline-3-carboxylate

Systemtic Name: 2-methoxyethyl (4S,4aR,7R)-2-methyl-5-oxidanylidene-7-phenyl-4-pyridin-3-yl-4,4a,6,7-tetrahydro-3H-quinoline-3-carboxylate Openeye Name: 2-methoxyethyl (4S,4aR,7R)-2-methyl-5-oxo-7-phenyl-4-(3-pyridyl)-4,4a,6,7-tetrahydro-3H-quinoline-3-carboxylate CAS Name: (4S,4aR,7R)-2-methyl-5-oxo-7-phenyl-4-(3-pyridinyl)-4,4a,6,7-tetrahydro-3H-quinoline-3-carboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl (4S,4aR,7R)-2-methyl-5-oxo-7-phenyl-4-pyridin-3-yl-4,4a,6,7-tetrahydro-3H-quinoline-3-carboxylate Traditional Name: (4S,4aR,7R)-5-keto-2-methyl-7-phenyl-4-(3-pyridyl)-4,4a,6,7-tetrahydro-3H-quinoline-3-carboxylic acid 2-methoxyethyl ester Formula: C25H26N2O4 MolecularWeight: 418.48494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC(CC(=O)C2C(C1C(=O)OCCOC)C3=CN=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=NC2=C[C@@H](CC(=O)[C@@H]2[C@@H](C1C(=O)OCCOC)C3=CN=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H26N2O4/c1-16-22(25(29)31-12-11-30-2)23(18-9-6-10-26-15-18)24-20(27-16)13-19(14-21(24)28)17-7-4-3-5-8-17/h3-10,13,15,19,22-24H,11-12,14H2,1-2H3/t19-,22?,23+,24+/m0/s1