(phenylmethyl) (2S)-2-[[(2S)-3-[4-[bis(2-chloroethyl)amino]phenyl]-1-oxidanylidene-1-phenylmethoxy-propan-2-yl]carbamoyl]-5-oxidanylidene-pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) (2S)-2-[[(2S)-3-[4-[bis(2-chloroethyl)amino]phenyl]-1-oxidanylidene-1-phenylmethoxy-propan-2-yl]carbamoyl]-5-oxidanylidene-pyrrolidine-1-carboxylate Openeye Name: benzyl (2S)-2-[[(1S)-2-benzyloxy-1-[[4-[bis(2-chloroethyl)amino]phenyl]methyl]-2-oxo-ethyl]carbamoyl]-5-oxo-pyrrolidine-1-carboxylate CAS Name: (2S)-2-[[[(2S)-3-[4-[bis(2-chloroethyl)amino]phenyl]-1-oxo-1-phenylmethoxypropan-2-yl]amino]-oxomethyl]-5-oxo-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-2-[[(2S)-3-[4-[bis(2-chloroethyl)amino]phenyl]-1-oxo-1-phenylmethoxypropan-2-yl]carbamoyl]-5-oxopyrrolidine-1-carboxylate Traditional Name: (2S)-2-[[(1S)-2-benzoxy-1-[4-[bis(2-chloroethyl)amino]benzyl]-2-keto-ethyl]carbamoyl]-5-keto-pyrrolidine-1-carboxylic acid benzyl ester Formula: C33H35Cl2N3O6 MolecularWeight: 640.5535

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1C(=O)NC(CC2=CC=C(C=C2)N(CCCl)CCCl)C(=O)OCC3=CC=CC=C3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1CC(=O)N([C@@H]1C(=O)N[C@@H](CC2=CC=C(C=C2)N(CCCl)CCCl)C(=O)OCC3=CC=CC=C3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C33H35Cl2N3O6/c34-17-19-37(20-18-35)27-13-11-24(12-14-27)21-28(32(41)43-22-25-7-3-1-4-8-25)36-31(40)29-15-16-30(39)38(29)33(42)44-23-26-9-5-2-6-10-26/h1-14,28-29H,15-23H2,(H,36,40)/t28-,29-/m0/s1