prop-2-enyl 3-azanyl-4-[3-methoxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-propyl]sulfanyl-benzoate

Systemtic Name: prop-2-enyl 3-azanyl-4-[3-methoxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-propyl]sulfanyl-benzoate Openeye Name: allyl 3-amino-4-[2-(tert-butoxycarbonylamino)-3-methoxy-3-oxo-propyl]sulfanyl-benzoate CAS Name: 3-amino-4-[[3-methoxy-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-oxopropyl]thio]benzoic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 3-amino-4-[3-methoxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanylbenzoate Traditional Name: 3-amino-4-[[2-(tert-butoxycarbonylamino)-3-keto-3-methoxy-propyl]thio]benzoic acid allyl ester Formula: C19H26N2O6S MolecularWeight: 410.48454

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CSC1=C(C=C(C=C1)C(=O)OCC=C)N)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)NC(CSC1=C(C=C(C=C1)C(=O)OCC=C)N)C(=O)OC

InChI

InChI=1S/C19H26N2O6S/c1-6-9-26-16(22)12-7-8-15(13(20)10-12)28-11-14(17(23)25-5)21-18(24)27-19(2,3)4/h6-8,10,14H,1,9,11,20H2,2-5H3,(H,21,24)