1-[2-[(4-methoxy-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl]-N-phenyl-piperidine-3-carboxamide

Systemtic Name: 1-[2-[(4-methoxy-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl]-N-phenyl-piperidine-3-carboxamide Openeye Name: 1-[2-(4-methoxy-2-nitro-anilino)-2-oxo-ethyl]-N-phenyl-piperidine-3-carboxamide CAS Name: 1-[2-(4-methoxy-2-nitroanilino)-2-oxoethyl]-N-phenyl-3-piperidinecarboxamide IUPAC Name: 1-[2-(4-methoxy-2-nitroanilino)-2-oxoethyl]-N-phenylpiperidine-3-carboxamide Traditional Name: 1-[2-keto-2-(4-methoxy-2-nitro-anilino)ethyl]-N-phenyl-nipecotamide Formula: C21H24N4O5 MolecularWeight: 412.43906

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)CN2CCCC(C2)C(=O)NC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)CN2CCCC(C2)C(=O)NC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H24N4O5/c1-30-17-9-10-18(19(12-17)25(28)29)23-20(26)14-24-11-5-6-15(13-24)21(27)22-16-7-3-2-4-8-16/h2-4,7-10,12,15H,5-6,11,13-14H2,1H3,(H,22,27)(H,23,26)