propan-2-yl 6-azanyl-2-(chloromethyl)-5-cyano-4-(4-nitrophenyl)-4H-pyran-3-carboxylate

Systemtic Name: propan-2-yl 6-azanyl-2-(chloromethyl)-5-cyano-4-(4-nitrophenyl)-4H-pyran-3-carboxylate Openeye Name: isopropyl 6-amino-2-(chloromethyl)-5-cyano-4-(4-nitrophenyl)-4H-pyran-3-carboxylate CAS Name: 6-amino-2-(chloromethyl)-5-cyano-4-(4-nitrophenyl)-4H-pyran-3-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 6-amino-2-(chloromethyl)-5-cyano-4-(4-nitrophenyl)-4H-pyran-3-carboxylate Traditional Name: 6-amino-2-(chloromethyl)-5-cyano-4-(4-nitrophenyl)-4H-pyran-3-carboxylic acid isopropyl ester Formula: C17H16ClN3O5 MolecularWeight: 377.77904

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=C(OC(=C(C1C2=CC=C(C=C2)[N+](=O)[O-])C#N)N)CCl

Isomeric SMILES

CC(C)OC(=O)C1=C(OC(=C(C1C2=CC=C(C=C2)[N+](=O)[O-])C#N)N)CCl

InChI

InChI=1S/C17H16ClN3O5/c1-9(2)25-17(22)15-13(7-18)26-16(20)12(8-19)14(15)10-3-5-11(6-4-10)21(23)24/h3-6,9,14H,7,20H2,1-2H3