(3-butoxy-3-oxidanylidene-propyl) (E)-5-(4-chloranyl-3-nitro-phenyl)-3-oxidanylidene-pent-4-enoate

Systemtic Name: (3-butoxy-3-oxidanylidene-propyl) (E)-5-(4-chloranyl-3-nitro-phenyl)-3-oxidanylidene-pent-4-enoate Openeye Name: (3-butoxy-3-oxo-propyl) (E)-5-(4-chloro-3-nitro-phenyl)-3-oxo-pent-4-enoate CAS Name: (E)-5-(4-chloro-3-nitrophenyl)-3-oxo-4-pentenoic acid (3-butoxy-3-oxopropyl) ester IUPAC Name: (3-butoxy-3-oxopropyl) (E)-5-(4-chloro-3-nitrophenyl)-3-oxopent-4-enoate Traditional Name: (E)-5-(4-chloro-3-nitro-phenyl)-3-keto-pent-4-enoic acid (3-butoxy-3-keto-propyl) ester Formula: C18H20ClNO7 MolecularWeight: 397.8069

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CCOC(=O)CC(=O)C=CC1=CC(=C(C=C1)Cl)[N+](=O)[O-]

Isomeric SMILES

CCCCOC(=O)CCOC(=O)CC(=O)/C=C/C1=CC(=C(C=C1)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H20ClNO7/c1-2-3-9-26-17(22)8-10-27-18(23)12-14(21)6-4-13-5-7-15(19)16(11-13)20(24)25/h4-7,11H,2-3,8-10,12H2,1H3/b6-4+