ethyl 2-acetamido-3-acetyloxy-3-[3-[bis(2-chloroethyl)amino]phenyl]propanoate

Systemtic Name: ethyl 2-acetamido-3-acetyloxy-3-[3-[bis(2-chloroethyl)amino]phenyl]propanoate Openeye Name: ethyl 2-acetamido-3-acetoxy-3-[3-[bis(2-chloroethyl)amino]phenyl]propanoate CAS Name: 2-acetamido-3-acetyloxy-3-[3-[bis(2-chloroethyl)amino]phenyl]propanoic acid ethyl ester IUPAC Name: ethyl 2-acetamido-3-acetyloxy-3-[3-[bis(2-chloroethyl)amino]phenyl]propanoate Traditional Name: 2-acetamido-3-acetoxy-3-[3-[bis(2-chloroethyl)amino]phenyl]propionic acid ethyl ester Formula: C19H26Cl2N2O5 MolecularWeight: 433.32614

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C1=CC(=CC=C1)N(CCCl)CCCl)OC(=O)C)NC(=O)C

Isomeric SMILES

CCOC(=O)C(C(C1=CC(=CC=C1)N(CCCl)CCCl)OC(=O)C)NC(=O)C

InChI

InChI=1S/C19H26Cl2N2O5/c1-4-27-19(26)17(22-13(2)24)18(28-14(3)25)15-6-5-7-16(12-15)23(10-8-20)11-9-21/h5-7,12,17-18H,4,8-11H2,1-3H3,(H,22,24)