4-[[4-(diethylcarbamoyl)phenyl]-(3-nitrophenyl)methylidene]piperidine-1-carboxylic acid

Systemtic Name: 4-[[4-(diethylcarbamoyl)phenyl]-(3-nitrophenyl)methylidene]piperidine-1-carboxylic acid Openeye Name: 4-[[4-(diethylcarbamoyl)phenyl]-(3-nitrophenyl)methylene]piperidine-1-carboxylic acid CAS Name: 4-[[4-[diethylamino(oxo)methyl]phenyl]-(3-nitrophenyl)methylidene]-1-piperidinecarboxylic acid IUPAC Name: 4-[[4-(diethylcarbamoyl)phenyl]-(3-nitrophenyl)methylidene]piperidine-1-carboxylic acid Traditional Name: 4-[[4-(diethylcarbamoyl)phenyl]-(3-nitrophenyl)methylene]piperidine-1-carboxylic acid Formula: C24H27N3O5 MolecularWeight: 437.48828

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)C(=C2CCN(CC2)C(=O)O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)C(=C2CCN(CC2)C(=O)O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C24H27N3O5/c1-3-25(4-2)23(28)19-10-8-17(9-11-19)22(18-12-14-26(15-13-18)24(29)30)20-6-5-7-21(16-20)27(31)32/h5-11,16H,3-4,12-15H2,1-2H3,(H,29,30)