tert-butyl-[1-[4-(4-ethoxycarbonylpiperazin-1-yl)carbonylphenyl]piperidin-4-yl]azanium

Systemtic Name: tert-butyl-[1-[4-(4-ethoxycarbonylpiperazin-1-yl)carbonylphenyl]piperidin-4-yl]azanium Openeye Name: tert-butyl-[1-[4-(4-ethoxycarbonylpiperazine-1-carbonyl)phenyl]-4-piperidyl]ammonium CAS Name: tert-butyl-[1-[4-[(4-ethoxycarbonyl-1-piperazinyl)-oxomethyl]phenyl]-4-piperidinyl]ammonium IUPAC Name: tert-butyl-[1-[4-(4-ethoxycarbonylpiperazine-1-carbonyl)phenyl]piperidin-4-yl]azanium Traditional Name: tert-butyl-[1-[4-(4-carbethoxypiperazine-1-carbonyl)phenyl]-4-piperidyl]ammonium Formula: C23H37N4O3+ MolecularWeight: 417.56488

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H36N4O3/c1-5-30-22(29)27-16-14-26(15-17-27)21(28)18-6-8-20(9-7-18)25-12-10-19(11-13-25)24-23(2,3)4/h6-9,19,24H,5,10-17H2,1-4H3/p+1