butan-2-yl-ethyl-[3-[4-[(2-phenylphenyl)carbamoyloxy]piperidin-1-yl]propyl]azanium

Systemtic Name: butan-2-yl-ethyl-[3-[4-[(2-phenylphenyl)carbamoyloxy]piperidin-1-yl]propyl]azanium Openeye Name: ethyl-[3-[4-[(2-phenylphenyl)carbamoyloxy]-1-piperidyl]propyl]-sec-butyl-ammonium CAS Name: butan-2-yl-ethyl-[3-[4-[oxo-(2-phenylanilino)methoxy]-1-piperidinyl]propyl]ammonium IUPAC Name: butan-2-yl-ethyl-[3-[4-[(2-phenylphenyl)carbamoyloxy]piperidin-1-yl]propyl]azanium Traditional Name: ethyl-[3-[4-[(2-phenylphenyl)carbamoyloxy]piperidino]propyl]-sec-butyl-ammonium Formula: C27H40N3O2+ MolecularWeight: 438.6254

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)[NH+](CC)CCCN1CCC(CC1)OC(=O)NC2=CC=CC=C2C3=CC=CC=C3

Isomeric SMILES

CCC(C)[NH+](CC)CCCN1CCC(CC1)OC(=O)NC2=CC=CC=C2C3=CC=CC=C3

InChI

InChI=1S/C27H39N3O2/c1-4-22(3)30(5-2)19-11-18-29-20-16-24(17-21-29)32-27(31)28-26-15-10-9-14-25(26)23-12-7-6-8-13-23/h6-10,12-15,22,24H,4-5,11,16-21H2,1-3H3,(H,28,31)/p+1