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

Systemtic Name: phenethyl (4S,7R)-2-methyl-5-oxidanylidene-7-phenyl-4-pyridin-4-yl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate Openeye Name: phenethyl (4S,7R)-2-methyl-5-oxo-7-phenyl-4-(4-pyridyl)-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate CAS Name: (4S,7R)-2-methyl-5-oxo-7-phenyl-4-pyridin-4-yl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylic acid phenethyl ester IUPAC Name: phenethyl (4S,7R)-2-methyl-5-oxo-7-phenyl-4-pyridin-4-yl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate Traditional Name: (4S,7R)-5-keto-2-methyl-7-phenyl-4-(4-pyridyl)-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylic acid phenethyl ester Formula: C30H28N2O3 MolecularWeight: 464.55492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(C1C(=O)OCCC3=CC=CC=C3)C4=CC=NC=C4)C(=O)CC(C2)C5=CC=CC=C5

Isomeric SMILES

CC1=NC2=C([C@@H](C1C(=O)OCCC3=CC=CC=C3)C4=CC=NC=C4)C(=O)C[C@@H](C2)C5=CC=CC=C5

InChI

InChI=1S/C30H28N2O3/c1-20-27(30(34)35-17-14-21-8-4-2-5-9-21)28(23-12-15-31-16-13-23)29-25(32-20)18-24(19-26(29)33)22-10-6-3-7-11-22/h2-13,15-16,24,27-28H,14,17-19H2,1H3/t24-,27?,28-/m1/s1