[1-[4-[3-(4-cyclopropylcarbonylphenoxy)propyl]piperazin-1-yl]-1-oxidanylidene-butan-2-yl]carbamic acid

Systemtic Name: [1-[4-[3-(4-cyclopropylcarbonylphenoxy)propyl]piperazin-1-yl]-1-oxidanylidene-butan-2-yl]carbamic acid Openeye Name: 1-[4-[3-[4-(cyclopropanecarbonyl)phenoxy]propyl]piperazine-1-carbonyl]propylcarbamic acid CAS Name: [1-[4-[3-[4-[cyclopropyl(oxo)methyl]phenoxy]propyl]-1-piperazinyl]-1-oxobutan-2-yl]carbamic acid IUPAC Name: [1-[4-[3-[4-(cyclopropanecarbonyl)phenoxy]propyl]piperazin-1-yl]-1-oxobutan-2-yl]carbamic acid Traditional Name: 1-[4-[3-[4-(cyclopropanecarbonyl)phenoxy]propyl]piperazine-1-carbonyl]propylcarbamic acid Formula: C22H31N3O5 MolecularWeight: 417.49864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1CCN(CC1)CCCOC2=CC=C(C=C2)C(=O)C3CC3)NC(=O)O

Isomeric SMILES

CCC(C(=O)N1CCN(CC1)CCCOC2=CC=C(C=C2)C(=O)C3CC3)NC(=O)O

InChI

InChI=1S/C22H31N3O5/c1-2-19(23-22(28)29)21(27)25-13-11-24(12-14-25)10-3-15-30-18-8-6-17(7-9-18)20(26)16-4-5-16/h6-9,16,19,23H,2-5,10-15H2,1H3,(H,28,29)