2-methoxyethyl (4S,4aS)-4-(2-bromophenyl)-2-methyl-5-oxidanylidene-4,4a,6,7-tetrahydro-3H-quinoline-3-carboxylate

Systemtic Name: 2-methoxyethyl (4S,4aS)-4-(2-bromophenyl)-2-methyl-5-oxidanylidene-4,4a,6,7-tetrahydro-3H-quinoline-3-carboxylate Openeye Name: 2-methoxyethyl (4S,4aS)-4-(2-bromophenyl)-2-methyl-5-oxo-4,4a,6,7-tetrahydro-3H-quinoline-3-carboxylate CAS Name: (4S,4aS)-4-(2-bromophenyl)-2-methyl-5-oxo-4,4a,6,7-tetrahydro-3H-quinoline-3-carboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl (4S,4aS)-4-(2-bromophenyl)-2-methyl-5-oxo-4,4a,6,7-tetrahydro-3H-quinoline-3-carboxylate Traditional Name: (4S,4aS)-4-(2-bromophenyl)-5-keto-2-methyl-4,4a,6,7-tetrahydro-3H-quinoline-3-carboxylic acid 2-methoxyethyl ester Formula: C20H22BrNO4 MolecularWeight: 420.29698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CCCC(=O)C2C(C1C(=O)OCCOC)C3=CC=CC=C3Br

Isomeric SMILES

CC1=NC2=CCCC(=O)[C@H]2[C@@H](C1C(=O)OCCOC)C3=CC=CC=C3Br

InChI

InChI=1S/C20H22BrNO4/c1-12-17(20(24)26-11-10-25-2)18(13-6-3-4-7-14(13)21)19-15(22-12)8-5-9-16(19)23/h3-4,6-8,17-19H,5,9-11H2,1-2H3/t17?,18-,19+/m1/s1