2-(3,5-dimethylpyrazol-1-yl)ethyl-[1-[4-(4-ethoxycarbonylpiperazin-1-yl)carbonylphenyl]piperidin-4-yl]azanium

Systemtic Name: 2-(3,5-dimethylpyrazol-1-yl)ethyl-[1-[4-(4-ethoxycarbonylpiperazin-1-yl)carbonylphenyl]piperidin-4-yl]azanium Openeye Name: 2-(3,5-dimethylpyrazol-1-yl)ethyl-[1-[4-(4-ethoxycarbonylpiperazine-1-carbonyl)phenyl]-4-piperidyl]ammonium CAS Name: 2-(3,5-dimethyl-1-pyrazolyl)ethyl-[1-[4-[(4-ethoxycarbonyl-1-piperazinyl)-oxomethyl]phenyl]-4-piperidinyl]ammonium IUPAC Name: 2-(3,5-dimethylpyrazol-1-yl)ethyl-[1-[4-(4-ethoxycarbonylpiperazine-1-carbonyl)phenyl]piperidin-4-yl]azanium Traditional Name: [1-[4-(4-carbethoxypiperazine-1-carbonyl)phenyl]-4-piperidyl]-[2-(3,5-dimethylpyrazol-1-yl)ethyl]ammonium Formula: C26H39N6O3+ MolecularWeight: 483.62626

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=C(C=C2)N3CCC(CC3)[NH2+]CCN4C(=CC(=N4)C)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=C(C=C2)N3CCC(CC3)[NH2+]CCN4C(=CC(=N4)C)C

InChI

InChI=1S/C26H38N6O3/c1-4-35-26(34)31-17-15-30(16-18-31)25(33)22-5-7-24(8-6-22)29-12-9-23(10-13-29)27-11-14-32-21(3)19-20(2)28-32/h5-8,19,23,27H,4,9-18H2,1-3H3/p+1