[4-[(2S)-3-methoxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-propyl]phenyl]sulfamic acid

Systemtic Name: [4-[(2S)-3-methoxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-propyl]phenyl]sulfamic acid Openeye Name: [4-[(2S)-2-(tert-butoxycarbonylamino)-3-methoxy-3-oxo-propyl]phenyl]sulfamic acid CAS Name: [4-[(2S)-3-methoxy-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-oxopropyl]phenyl]sulfamic acid IUPAC Name: [4-[(2S)-3-methoxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]phenyl]sulfamic acid Traditional Name: [4-[(2S)-2-(tert-butoxycarbonylamino)-3-keto-3-methoxy-propyl]phenyl]sulfamic acid Formula: C15H22N2O7S MolecularWeight: 374.40938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=C(C=C1)NS(=O)(=O)O)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CC=C(C=C1)NS(=O)(=O)O)C(=O)OC

InChI

InChI=1S/C15H22N2O7S/c1-15(2,3)24-14(19)16-12(13(18)23-4)9-10-5-7-11(8-6-10)17-25(20,21)22/h5-8,12,17H,9H2,1-4H3,(H,16,19)(H,20,21,22)/t12-/m0/s1