1-[2-azanyl-1-chloranyl-4-[(3,5-dimethoxyphenyl)methoxy]-5-oxidanylidene-5-phenyl-pentyl]piperidine-4-carboxamide

Systemtic Name: 1-[2-azanyl-1-chloranyl-4-[(3,5-dimethoxyphenyl)methoxy]-5-oxidanylidene-5-phenyl-pentyl]piperidine-4-carboxamide Openeye Name: 1-[2-amino-1-chloro-4-[(3,5-dimethoxyphenyl)methoxy]-5-oxo-5-phenyl-pentyl]piperidine-4-carboxamide CAS Name: 1-[2-amino-1-chloro-4-[(3,5-dimethoxyphenyl)methoxy]-5-oxo-5-phenylpentyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-amino-1-chloro-4-[(3,5-dimethoxyphenyl)methoxy]-5-oxo-5-phenylpentyl]piperidine-4-carboxamide Traditional Name: 1-[2-amino-1-chloro-4-(3,5-dimethoxybenzyl)oxy-5-keto-5-phenyl-pentyl]isonipecotamide Formula: C26H34ClN3O5 MolecularWeight: 504.01826

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)COC(CC(C(N2CCC(CC2)C(=O)N)Cl)N)C(=O)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=CC(=CC(=C1)COC(CC(C(N2CCC(CC2)C(=O)N)Cl)N)C(=O)C3=CC=CC=C3)OC

InChI

InChI=1S/C26H34ClN3O5/c1-33-20-12-17(13-21(14-20)34-2)16-35-23(24(31)18-6-4-3-5-7-18)15-22(28)25(27)30-10-8-19(9-11-30)26(29)32/h3-7,12-14,19,22-23,25H,8-11,15-16,28H2,1-2H3,(H2,29,32)