methyl 1-(3-heptoxy-3-oxidanylidene-propyl)-4-[phenyl(propanoyl)amino]piperidine-4-carboxylate

Systemtic Name: methyl 1-(3-heptoxy-3-oxidanylidene-propyl)-4-[phenyl(propanoyl)amino]piperidine-4-carboxylate Openeye Name: methyl 1-(3-heptoxy-3-oxo-propyl)-4-(N-propanoylanilino)piperidine-4-carboxylate CAS Name: 1-(3-heptoxy-3-oxopropyl)-4-[N-(1-oxopropyl)anilino]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(3-heptoxy-3-oxopropyl)-4-(N-propanoylanilino)piperidine-4-carboxylate Traditional Name: 1-(3-heptoxy-3-keto-propyl)-4-(N-propionylanilino)isonipecotic acid methyl ester Formula: C26H40N2O5 MolecularWeight: 460.6062

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)CCN1CCC(CC1)(C(=O)OC)N(C2=CC=CC=C2)C(=O)CC

Isomeric SMILES

CCCCCCCOC(=O)CCN1CCC(CC1)(C(=O)OC)N(C2=CC=CC=C2)C(=O)CC

InChI

InChI=1S/C26H40N2O5/c1-4-6-7-8-12-21-33-24(30)15-18-27-19-16-26(17-20-27,25(31)32-3)28(23(29)5-2)22-13-10-9-11-14-22/h9-11,13-14H,4-8,12,15-21H2,1-3H3