[4-[(3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrolidin-1-yl]phenyl]methylazanium

Systemtic Name: [4-[(3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrolidin-1-yl]phenyl]methylazanium Openeye Name: [4-[(3S)-3-(tert-butoxycarbonylamino)pyrrolidin-1-yl]phenyl]methylammonium CAS Name: [4-[(3S)-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-pyrrolidinyl]phenyl]methylammonium IUPAC Name: [4-[(3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrolidin-1-yl]phenyl]methylazanium Traditional Name: [4-[(3S)-3-(tert-butoxycarbonylamino)pyrrolidino]benzyl]ammonium Formula: C16H26N3O2+ MolecularWeight: 292.39654

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CCN(C1)C2=CC=C(C=C2)C[NH3+]

Isomeric SMILES

CC(C)(C)OC(=O)N[C@H]1CCN(C1)C2=CC=C(C=C2)C[NH3+]

InChI

InChI=1S/C16H25N3O2/c1-16(2,3)21-15(20)18-13-8-9-19(11-13)14-6-4-12(10-17)5-7-14/h4-7,13H,8-11,17H2,1-3H3,(H,18,20)/p+1/t13-/m0/s1