ethyl 3-(2-azanyl-3-cyano-6-methyl-5-phenylmethoxy-4H-pyran-4-yl)benzoate

Systemtic Name: ethyl 3-(2-azanyl-3-cyano-6-methyl-5-phenylmethoxy-4H-pyran-4-yl)benzoate Openeye Name: ethyl 3-(2-amino-5-benzyloxy-3-cyano-6-methyl-4H-pyran-4-yl)benzoate CAS Name: 3-(2-amino-3-cyano-6-methyl-5-phenylmethoxy-4H-pyran-4-yl)benzoic acid ethyl ester IUPAC Name: ethyl 3-(2-amino-3-cyano-6-methyl-5-phenylmethoxy-4H-pyran-4-yl)benzoate Traditional Name: 3-(2-amino-5-benzoxy-3-cyano-6-methyl-4H-pyran-4-yl)benzoic acid ethyl ester Formula: C23H22N2O4 MolecularWeight: 390.43178

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)C2C(=C(OC(=C2OCC3=CC=CC=C3)C)N)C#N

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)C2C(=C(OC(=C2OCC3=CC=CC=C3)C)N)C#N

InChI

InChI=1S/C23H22N2O4/c1-3-27-23(26)18-11-7-10-17(12-18)20-19(13-24)22(25)29-15(2)21(20)28-14-16-8-5-4-6-9-16/h4-12,20H,3,14,25H2,1-2H3