3-[2-[4-(3,4-dimethoxyphenyl)butylamino]-2-oxidanylidene-ethyl]-N-propyl-piperazine-1-carboxamide

Systemtic Name: 3-[2-[4-(3,4-dimethoxyphenyl)butylamino]-2-oxidanylidene-ethyl]-N-propyl-piperazine-1-carboxamide Openeye Name: 3-[2-[4-(3,4-dimethoxyphenyl)butylamino]-2-oxo-ethyl]-N-propyl-piperazine-1-carboxamide CAS Name: 3-[2-[4-(3,4-dimethoxyphenyl)butylamino]-2-oxoethyl]-N-propyl-1-piperazinecarboxamide IUPAC Name: 3-[2-[4-(3,4-dimethoxyphenyl)butylamino]-2-oxoethyl]-N-propylpiperazine-1-carboxamide Traditional Name: 3-[2-[4-(3,4-dimethoxyphenyl)butylamino]-2-keto-ethyl]-N-propyl-piperazine-1-carboxamide Formula: C22H36N4O4 MolecularWeight: 420.54564

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)N1CCNC(C1)CC(=O)NCCCCC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CCCNC(=O)N1CCNC(C1)CC(=O)NCCCCC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C22H36N4O4/c1-4-10-25-22(28)26-13-12-23-18(16-26)15-21(27)24-11-6-5-7-17-8-9-19(29-2)20(14-17)30-3/h8-9,14,18,23H,4-7,10-13,15-16H2,1-3H3,(H,24,27)(H,25,28)