8-[bis(2-chloroethyl)aminomethyl]-4-methyl-7-oxidanyl-chromen-2-one hydrochloride

Systemtic Name: 8-[bis(2-chloroethyl)aminomethyl]-4-methyl-7-oxidanyl-chromen-2-one hydrochloride Openeye Name: 8-[bis(2-chloroethyl)aminomethyl]-7-hydroxy-4-methyl-chromen-2-one hydrochloride CAS Name: 8-[bis(2-chloroethyl)aminomethyl]-7-hydroxy-4-methyl-1-benzopyran-2-one hydrochloride IUPAC Name: 8-[bis(2-chloroethyl)aminomethyl]-7-hydroxy-4-methylchromen-2-one hydrochloride Traditional Name: 8-[bis(2-chloroethyl)aminomethyl]-7-hydroxy-4-methyl-coumarin hydrochloride Formula: C15H18Cl3NO3 MolecularWeight: 366.66732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2CN(CCCl)CCCl)O.Cl

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2CN(CCCl)CCCl)O.Cl

InChI

InChI=1S/C15H17Cl2NO3.ClH/c1-10-8-14(20)21-15-11(10)2-3-13(19)12(15)9-18(6-4-16)7-5-17;/h2-3,8,19H,4-7,9H2,1H3;1H