2-[3-[bis(2-chloroethyl)aminomethyl]phenoxy]-N-(3-nitrophenyl)ethanamide

Systemtic Name: 2-[3-[bis(2-chloroethyl)aminomethyl]phenoxy]-N-(3-nitrophenyl)ethanamide Openeye Name: 2-[3-[bis(2-chloroethyl)aminomethyl]phenoxy]-N-(3-nitrophenyl)acetamide CAS Name: 2-[3-[bis(2-chloroethyl)aminomethyl]phenoxy]-N-(3-nitrophenyl)acetamide IUPAC Name: 2-[3-[bis(2-chloroethyl)aminomethyl]phenoxy]-N-(3-nitrophenyl)acetamide Traditional Name: 2-[3-[bis(2-chloroethyl)aminomethyl]phenoxy]-N-(3-nitrophenyl)acetamide Formula: C19H21Cl2N3O4 MolecularWeight: 426.29374

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCC(=O)NC2=CC(=CC=C2)[N+](=O)[O-])CN(CCCl)CCCl

Isomeric SMILES

C1=CC(=CC(=C1)OCC(=O)NC2=CC(=CC=C2)[N+](=O)[O-])CN(CCCl)CCCl

InChI

InChI=1S/C19H21Cl2N3O4/c20-7-9-23(10-8-21)13-15-3-1-6-18(11-15)28-14-19(25)22-16-4-2-5-17(12-16)24(26)27/h1-6,11-12H,7-10,13-14H2,(H,22,25)