methyl 4-[(2-methylpropan-2-yl)oxycarbonylamino]-1-(phenylmethyl)piperidin-1-ium-4-carboxylate

Systemtic Name: methyl 4-[(2-methylpropan-2-yl)oxycarbonylamino]-1-(phenylmethyl)piperidin-1-ium-4-carboxylate Openeye Name: methyl 1-benzyl-4-(tert-butoxycarbonylamino)piperidin-1-ium-4-carboxylate CAS Name: 4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-(phenylmethyl)-4-piperidin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl 1-benzyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]piperidin-1-ium-4-carboxylate Traditional Name: 1-benzyl-4-(tert-butoxycarbonylamino)piperidin-1-ium-4-carboxylic acid methyl ester Formula: C19H29N2O4+ MolecularWeight: 349.44456

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1(CC[NH+](CC1)CC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)NC1(CC[NH+](CC1)CC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C19H28N2O4/c1-18(2,3)25-17(23)20-19(16(22)24-4)10-12-21(13-11-19)14-15-8-6-5-7-9-15/h5-9H,10-14H2,1-4H3,(H,20,23)/p+1