bis(2-chloroethyl)-methanoyl-[3-[(1-oxidanyl-1-oxidanylidene-propan-2-yl)amino]phenyl]azanium

Systemtic Name: bis(2-chloroethyl)-methanoyl-[3-[(1-oxidanyl-1-oxidanylidene-propan-2-yl)amino]phenyl]azanium Openeye Name: bis(2-chloroethyl)-formyl-[3-[(2-hydroxy-1-methyl-2-oxo-ethyl)amino]phenyl]ammonium CAS Name: bis(2-chloroethyl)-formyl-[3-[(1-hydroxy-1-oxopropan-2-yl)amino]phenyl]ammonium IUPAC Name: bis(2-chloroethyl)-formyl-[3-[(1-hydroxy-1-oxopropan-2-yl)amino]phenyl]azanium Traditional Name: bis(2-chloroethyl)-formyl-[3-[(2-hydroxy-2-keto-1-methyl-ethyl)amino]phenyl]ammonium Formula: C14H19Cl2N2O3+ MolecularWeight: 334.21826

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC1=CC(=CC=C1)[N+](CCCl)(CCCl)C=O

Isomeric SMILES

CC(C(=O)O)NC1=CC(=CC=C1)[N+](CCCl)(CCCl)C=O

InChI

InChI=1S/C14H18Cl2N2O3/c1-11(14(20)21)17-12-3-2-4-13(9-12)18(10-19,7-5-15)8-6-16/h2-4,9-11,17H,5-8H2,1H3/p+1