[1-[4-(cyclopentylcarbonylamino)phenyl]piperidin-4-yl]-(2-oxidanyl-2-prop-2-enyl-pent-4-enyl)azanium

Systemtic Name: [1-[4-(cyclopentylcarbonylamino)phenyl]piperidin-4-yl]-(2-oxidanyl-2-prop-2-enyl-pent-4-enyl)azanium Openeye Name: (2-allyl-2-hydroxy-pent-4-enyl)-[1-[4-(cyclopentanecarbonylamino)phenyl]-4-piperidyl]ammonium CAS Name: [1-[4-[[cyclopentyl(oxo)methyl]amino]phenyl]-4-piperidinyl]-(2-hydroxy-2-prop-2-enylpent-4-enyl)ammonium IUPAC Name: [1-[4-(cyclopentanecarbonylamino)phenyl]piperidin-4-yl]-(2-hydroxy-2-prop-2-enylpent-4-enyl)azanium Traditional Name: (2-allyl-2-hydroxy-pent-4-enyl)-[1-[4-(cyclopentanecarbonylamino)phenyl]-4-piperidyl]ammonium Formula: C25H38N3O2+ MolecularWeight: 412.58812

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC(CC=C)(C[NH2+]C1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3CCCC3)O

Isomeric SMILES

C=CCC(CC=C)(C[NH2+]C1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3CCCC3)O

InChI

InChI=1S/C25H37N3O2/c1-3-15-25(30,16-4-2)19-26-21-13-17-28(18-14-21)23-11-9-22(10-12-23)27-24(29)20-7-5-6-8-20/h3-4,9-12,20-21,26,30H,1-2,5-8,13-19H2,(H,27,29)/p+1