[(E)-(3-nitro-4-piperidin-1-yl-phenyl)methylideneamino] 2,4-bis(chloranyl)benzoate

Systemtic Name: [(E)-(3-nitro-4-piperidin-1-yl-phenyl)methylideneamino] 2,4-bis(chloranyl)benzoate Openeye Name: [(E)-[3-nitro-4-(1-piperidyl)phenyl]methyleneamino] 2,4-dichlorobenzoate CAS Name: 2,4-dichlorobenzoic acid [(E)-[3-nitro-4-(1-piperidinyl)phenyl]methylideneamino] ester IUPAC Name: [(E)-(3-nitro-4-piperidin-1-ylphenyl)methylideneamino] 2,4-dichlorobenzoate Traditional Name: 2,4-dichlorobenzoic acid [(E)-(3-nitro-4-piperidino-benzylidene)amino] ester Formula: C19H17Cl2N3O4 MolecularWeight: 422.26198

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C=NOC(=O)C3=C(C=C(C=C3)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)/C=N/OC(=O)C3=C(C=C(C=C3)Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H17Cl2N3O4/c20-14-5-6-15(16(21)11-14)19(25)28-22-12-13-4-7-17(18(10-13)24(26)27)23-8-2-1-3-9-23/h4-7,10-12H,1-3,8-9H2/b22-12+