(phenylmethyl) (E,4S)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-7-oxidanylidene-7-[(triphenylmethyl)amino]hept-2-enoate

Systemtic Name: (phenylmethyl) (E,4S)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-7-oxidanylidene-7-[(triphenylmethyl)amino]hept-2-enoate Openeye Name: benzyl (E,4S)-4-(tert-butoxycarbonylamino)-7-oxo-7-(tritylamino)hept-2-enoate CAS Name: (E,4S)-4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-7-oxo-7-[(triphenylmethyl)amino]-2-heptenoic acid (phenylmethyl) ester IUPAC Name: benzyl (E,4S)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-7-oxo-7-(tritylamino)hept-2-enoate Traditional Name: (E,4S)-4-(tert-butoxycarbonylamino)-7-keto-7-(tritylamino)hept-2-enoic acid benzyl ester Formula: C38H40N2O5 MolecularWeight: 604.7346

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCC(=O)NC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)C=CC(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CCC(=O)NC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)/C=C/C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C38H40N2O5/c1-37(2,3)45-36(43)39-33(25-27-35(42)44-28-29-16-8-4-9-17-29)24-26-34(41)40-38(30-18-10-5-11-19-30,31-20-12-6-13-21-31)32-22-14-7-15-23-32/h4-23,25,27,33H,24,26,28H2,1-3H3,(H,39,43)(H,40,41)/b27-25+/t33-/m0/s1