[(E)-(3-nitro-4-pyrrolidin-1-yl-phenyl)methylideneamino] 4-chloranylbenzoate

Systemtic Name: [(E)-(3-nitro-4-pyrrolidin-1-yl-phenyl)methylideneamino] 4-chloranylbenzoate Openeye Name: [(E)-(3-nitro-4-pyrrolidin-1-yl-phenyl)methyleneamino] 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [(E)-[3-nitro-4-(1-pyrrolidinyl)phenyl]methylideneamino] ester IUPAC Name: [(E)-(3-nitro-4-pyrrolidin-1-ylphenyl)methylideneamino] 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [(E)-(3-nitro-4-pyrrolidino-benzylidene)amino] ester Formula: C18H16ClN3O4 MolecularWeight: 373.79034

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C=NOC(=O)C3=CC=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)/C=N/OC(=O)C3=CC=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H16ClN3O4/c19-15-6-4-14(5-7-15)18(23)26-20-12-13-3-8-16(17(11-13)22(24)25)21-9-1-2-10-21/h3-8,11-12H,1-2,9-10H2/b20-12+