tert-butyl 4-[4-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]imidazol-1-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]imidazol-1-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-[(E)-3-methoxy-3-oxo-prop-1-enyl]imidazol-1-yl]piperidine-1-carboxylate CAS Name: 4-[4-[(E)-3-methoxy-3-oxoprop-1-enyl]-1-imidazolyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[(E)-3-methoxy-3-oxoprop-1-enyl]imidazol-1-yl]piperidine-1-carboxylate Traditional Name: 4-[4-[(E)-3-keto-3-methoxy-prop-1-enyl]imidazol-1-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C17H25N3O4 MolecularWeight: 335.3981

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)N2C=C(N=C2)C=CC(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)N2C=C(N=C2)/C=C/C(=O)OC

InChI

InChI=1S/C17H25N3O4/c1-17(2,3)24-16(22)19-9-7-14(8-10-19)20-11-13(18-12-20)5-6-15(21)23-4/h5-6,11-12,14H,7-10H2,1-4H3/b6-5+