[1-[4-(4-ethoxycarbonylpiperazin-1-yl)carbonylphenyl]piperidin-4-yl]-methyl-(1,2-oxazol-3-ylmethyl)azanium

Systemtic Name: [1-[4-(4-ethoxycarbonylpiperazin-1-yl)carbonylphenyl]piperidin-4-yl]-methyl-(1,2-oxazol-3-ylmethyl)azanium Openeye Name: [1-[4-(4-ethoxycarbonylpiperazine-1-carbonyl)phenyl]-4-piperidyl]-(isoxazol-3-ylmethyl)-methyl-ammonium CAS Name: [1-[4-[(4-ethoxycarbonyl-1-piperazinyl)-oxomethyl]phenyl]-4-piperidinyl]-(3-isoxazolylmethyl)-methylammonium IUPAC Name: [1-[4-(4-ethoxycarbonylpiperazine-1-carbonyl)phenyl]piperidin-4-yl]-methyl-(1,2-oxazol-3-ylmethyl)azanium Traditional Name: [1-[4-(4-carbethoxypiperazine-1-carbonyl)phenyl]-4-piperidyl]-(isoxazol-3-ylmethyl)-methyl-ammonium Formula: C24H34N5O4+ MolecularWeight: 456.55786

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=C(C=C2)N3CCC(CC3)[NH+](C)CC4=NOC=C4

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=C(C=C2)N3CCC(CC3)[NH+](C)CC4=NOC=C4

InChI

InChI=1S/C24H33N5O4/c1-3-32-24(31)29-15-13-28(14-16-29)23(30)19-4-6-22(7-5-19)27-11-8-21(9-12-27)26(2)18-20-10-17-33-25-20/h4-7,10,17,21H,3,8-9,11-16,18H2,1-2H3/p+1