ethyl 2-azanyl-4-(1-cyano-2-ethoxy-2-oxidanylidene-ethyl)-6-phenyl-4H-chromene-3-carboxylate

Systemtic Name: ethyl 2-azanyl-4-(1-cyano-2-ethoxy-2-oxidanylidene-ethyl)-6-phenyl-4H-chromene-3-carboxylate Openeye Name: ethyl 2-amino-4-(1-cyano-2-ethoxy-2-oxo-ethyl)-6-phenyl-4H-chromene-3-carboxylate CAS Name: 2-amino-4-(1-cyano-2-ethoxy-2-oxoethyl)-6-phenyl-4H-1-benzopyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-4-(1-cyano-2-ethoxy-2-oxoethyl)-6-phenyl-4H-chromene-3-carboxylate Traditional Name: 2-amino-4-(1-cyano-2-ethoxy-2-keto-ethyl)-6-phenyl-4H-chromene-3-carboxylic acid ethyl ester Formula: C23H22N2O5 MolecularWeight: 406.43118

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C(C1C(C#N)C(=O)OCC)C=C(C=C2)C3=CC=CC=C3)N

Isomeric SMILES

CCOC(=O)C1=C(OC2=C(C1C(C#N)C(=O)OCC)C=C(C=C2)C3=CC=CC=C3)N

InChI

InChI=1S/C23H22N2O5/c1-3-28-22(26)17(13-24)19-16-12-15(14-8-6-5-7-9-14)10-11-18(16)30-21(25)20(19)23(27)29-4-2/h5-12,17,19H,3-4,25H2,1-2H3