N-[4-[bis(2-chloroethyl)aminomethyl]phenyl]-7-chloranyl-quinolin-4-amine

Systemtic Name: N-[4-[bis(2-chloroethyl)aminomethyl]phenyl]-7-chloranyl-quinolin-4-amine Openeye Name: N-[4-[bis(2-chloroethyl)aminomethyl]phenyl]-7-chloro-quinolin-4-amine CAS Name: N-[4-[bis(2-chloroethyl)aminomethyl]phenyl]-7-chloro-4-quinolinamine IUPAC Name: N-[4-[bis(2-chloroethyl)aminomethyl]phenyl]-7-chloroquinolin-4-amine Traditional Name: bis(2-chloroethyl)-[4-[(7-chloro-4-quinolyl)amino]benzyl]amine Formula: C20H20Cl3N3 MolecularWeight: 408.7519

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN(CCCl)CCCl)NC2=C3C=CC(=CC3=NC=C2)Cl

Isomeric SMILES

C1=CC(=CC=C1CN(CCCl)CCCl)NC2=C3C=CC(=CC3=NC=C2)Cl

InChI

InChI=1S/C20H20Cl3N3/c21-8-11-26(12-9-22)14-15-1-4-17(5-2-15)25-19-7-10-24-20-13-16(23)3-6-18(19)20/h1-7,10,13H,8-9,11-12,14H2,(H,24,25)