[1-[4-[(3S)-3-oxidanylpiperidin-1-yl]carbonylphenyl]piperidin-4-yl]-propan-2-yl-azanium

Systemtic Name: [1-[4-[(3S)-3-oxidanylpiperidin-1-yl]carbonylphenyl]piperidin-4-yl]-propan-2-yl-azanium Openeye Name: [1-[4-[(3S)-3-hydroxypiperidine-1-carbonyl]phenyl]-4-piperidyl]-isopropyl-ammonium CAS Name: [1-[4-[[(3S)-3-hydroxy-1-piperidinyl]-oxomethyl]phenyl]-4-piperidinyl]-propan-2-ylammonium IUPAC Name: [1-[4-[(3S)-3-hydroxypiperidine-1-carbonyl]phenyl]piperidin-4-yl]-propan-2-ylazanium Traditional Name: [1-[4-[(3S)-3-hydroxypiperidine-1-carbonyl]phenyl]-4-piperidyl]-isopropyl-ammonium Formula: C20H32N3O2+ MolecularWeight: 346.48698

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH2+]C1CCN(CC1)C2=CC=C(C=C2)C(=O)N3CCCC(C3)O

Isomeric SMILES

CC(C)[NH2+]C1CCN(CC1)C2=CC=C(C=C2)C(=O)N3CCC[C@@H](C3)O

InChI

InChI=1S/C20H31N3O2/c1-15(2)21-17-9-12-22(13-10-17)18-7-5-16(6-8-18)20(25)23-11-3-4-19(24)14-23/h5-8,15,17,19,21,24H,3-4,9-14H2,1-2H3/p+1/t19-/m0/s1