ethyl (1R,2R,3R)-4-cyano-1-(4-methoxyphenyl)-2-methyl-2,3-dihydro-1H-pyrido[2,1-b][1,3]benzoxazole-3-carboxylate

Systemtic Name: ethyl (1R,2R,3R)-4-cyano-1-(4-methoxyphenyl)-2-methyl-2,3-dihydro-1H-pyrido[2,1-b][1,3]benzoxazole-3-carboxylate Openeye Name: ethyl (1R,2R,3R)-4-cyano-1-(4-methoxyphenyl)-2-methyl-2,3-dihydro-1H-pyrido[2,1-b][1,3]benzoxazole-3-carboxylate CAS Name: (1R,2R,3R)-4-cyano-1-(4-methoxyphenyl)-2-methyl-2,3-dihydro-1H-pyrido[2,1-b][1,3]benzoxazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl (1R,2R,3R)-4-cyano-1-(4-methoxyphenyl)-2-methyl-2,3-dihydro-1H-pyrido[2,1-b][1,3]benzoxazole-3-carboxylate Traditional Name: (1R,2R,3R)-4-cyano-1-(4-methoxyphenyl)-2-methyl-2,3-dihydro-1H-pyrido[2,1-b][1,3]benzoxazole-3-carboxylic acid ethyl ester Formula: C23H22N2O4 MolecularWeight: 390.43178

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(C(N2C3=CC=CC=C3OC2=C1C#N)C4=CC=C(C=C4)OC)C

Isomeric SMILES

CCOC(=O)[C@@H]1[C@H]([C@@H](N2C3=CC=CC=C3OC2=C1C#N)C4=CC=C(C=C4)OC)C

InChI

InChI=1S/C23H22N2O4/c1-4-28-23(26)20-14(2)21(15-9-11-16(27-3)12-10-15)25-18-7-5-6-8-19(18)29-22(25)17(20)13-24/h5-12,14,20-21H,4H2,1-3H3/t14-,20-,21-/m1/s1