2-[bis(2-chloroethyl)aminomethyl]-4-[(6-chloranyl-2-phenyl-acridin-9-yl)amino]phenol

Systemtic Name: 2-[bis(2-chloroethyl)aminomethyl]-4-[(6-chloranyl-2-phenyl-acridin-9-yl)amino]phenol Openeye Name: 2-[bis(2-chloroethyl)aminomethyl]-4-[(6-chloro-2-phenyl-acridin-9-yl)amino]phenol CAS Name: 2-[bis(2-chloroethyl)aminomethyl]-4-[(6-chloro-2-phenyl-9-acridinyl)amino]phenol IUPAC Name: 2-[bis(2-chloroethyl)aminomethyl]-4-[(6-chloro-2-phenylacridin-9-yl)amino]phenol Traditional Name: 2-[bis(2-chloroethyl)aminomethyl]-4-[(6-chloro-2-phenyl-acridin-9-yl)amino]phenol Formula: C30H26Cl3N3O MolecularWeight: 550.90594

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC3=C(C4=C(C=C(C=C4)Cl)N=C3C=C2)NC5=CC(=C(C=C5)O)CN(CCCl)CCCl

Isomeric SMILES

C1=CC=C(C=C1)C2=CC3=C(C4=C(C=C(C=C4)Cl)N=C3C=C2)NC5=CC(=C(C=C5)O)CN(CCCl)CCCl

InChI

InChI=1S/C30H26Cl3N3O/c31-12-14-36(15-13-32)19-22-16-24(8-11-29(22)37)34-30-25-9-7-23(33)18-28(25)35-27-10-6-21(17-26(27)30)20-4-2-1-3-5-20/h1-11,16-18,37H,12-15,19H2,(H,34,35)