[1-[3-(2-cyclopentylethanoylamino)phenyl]piperidin-4-yl]-(1-ethoxycarbonylpiperidin-4-yl)azanium

Systemtic Name: [1-[3-(2-cyclopentylethanoylamino)phenyl]piperidin-4-yl]-(1-ethoxycarbonylpiperidin-4-yl)azanium Openeye Name: [1-[3-[(2-cyclopentylacetyl)amino]phenyl]-4-piperidyl]-(1-ethoxycarbonyl-4-piperidyl)ammonium CAS Name: [1-[3-[(2-cyclopentyl-1-oxoethyl)amino]phenyl]-4-piperidinyl]-(1-ethoxycarbonyl-4-piperidinyl)ammonium IUPAC Name: [1-[3-[(2-cyclopentylacetyl)amino]phenyl]piperidin-4-yl]-(1-ethoxycarbonylpiperidin-4-yl)azanium Traditional Name: (1-carbethoxy-4-piperidyl)-[1-[3-[(2-cyclopentylacetyl)amino]phenyl]-4-piperidyl]ammonium Formula: C26H41N4O3+ MolecularWeight: 457.62874

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)[NH2+]C2CCN(CC2)C3=CC(=CC=C3)NC(=O)CC4CCCC4

Isomeric SMILES

CCOC(=O)N1CCC(CC1)[NH2+]C2CCN(CC2)C3=CC(=CC=C3)NC(=O)CC4CCCC4

InChI

InChI=1S/C26H40N4O3/c1-2-33-26(32)30-16-12-22(13-17-30)27-21-10-14-29(15-11-21)24-9-5-8-23(19-24)28-25(31)18-20-6-3-4-7-20/h5,8-9,19-22,27H,2-4,6-7,10-18H2,1H3,(H,28,31)/p+1