butyl 4-[4-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-3-phenylmethoxy-propyl]phenoxy]-3-prop-1-en-2-yl-benzoate

Systemtic Name: butyl 4-[4-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-3-phenylmethoxy-propyl]phenoxy]-3-prop-1-en-2-yl-benzoate Openeye Name: butyl 4-[4-[(2S)-3-benzyloxy-2-(tert-butoxycarbonylamino)-3-oxo-propyl]phenoxy]-3-isopropenyl-benzoate CAS Name: 3-(1-methylethenyl)-4-[4-[(2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-oxo-3-phenylmethoxypropyl]phenoxy]benzoic acid butyl ester IUPAC Name: butyl 4-[4-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxo-3-phenylmethoxypropyl]phenoxy]-3-prop-1-en-2-ylbenzoate Traditional Name: 4-[4-[(2S)-3-benzoxy-2-(tert-butoxycarbonylamino)-3-keto-propyl]phenoxy]-3-isopropenyl-benzoic acid butyl ester Formula: C35H41NO7 MolecularWeight: 587.70254

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC(=C(C=C1)OC2=CC=C(C=C2)CC(C(=O)OCC3=CC=CC=C3)NC(=O)OC(C)(C)C)C(=C)C

Isomeric SMILES

CCCCOC(=O)C1=CC(=C(C=C1)OC2=CC=C(C=C2)C[C@@H](C(=O)OCC3=CC=CC=C3)NC(=O)OC(C)(C)C)C(=C)C

InChI

InChI=1S/C35H41NO7/c1-7-8-20-40-32(37)27-16-19-31(29(22-27)24(2)3)42-28-17-14-25(15-18-28)21-30(36-34(39)43-35(4,5)6)33(38)41-23-26-12-10-9-11-13-26/h9-19,22,30H,2,7-8,20-21,23H2,1,3-6H3,(H,36,39)/t30-/m0/s1