2-[1,3-bis[[4-[bis(2-chloroethyl)amino]-2-methyl-phenyl]methyl]-1,3-diazinan-2-yl]-3,5-bis(chloranyl)phenol

Systemtic Name: 2-[1,3-bis[[4-[bis(2-chloroethyl)amino]-2-methyl-phenyl]methyl]-1,3-diazinan-2-yl]-3,5-bis(chloranyl)phenol Openeye Name: 2-[1,3-bis[[4-[bis(2-chloroethyl)amino]-2-methyl-phenyl]methyl]hexahydropyrimidin-2-yl]-3,5-dichloro-phenol CAS Name: 2-[1,3-bis[[4-[bis(2-chloroethyl)amino]-2-methylphenyl]methyl]-1,3-diazinan-2-yl]-3,5-dichlorophenol IUPAC Name: 2-[1,3-bis[[4-[bis(2-chloroethyl)amino]-2-methylphenyl]methyl]-1,3-diazinan-2-yl]-3,5-dichlorophenol Traditional Name: 2-[1,3-bis[4-[bis(2-chloroethyl)amino]-2-methyl-benzyl]hexahydropyrimidin-2-yl]-3,5-dichloro-phenol Formula: C34H42Cl6N4O MolecularWeight: 735.44148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N(CCCl)CCCl)CN2CCCN(C2C3=C(C=C(C=C3O)Cl)Cl)CC4=C(C=C(C=C4)N(CCCl)CCCl)C

Isomeric SMILES

CC1=C(C=CC(=C1)N(CCCl)CCCl)CN2CCCN(C2C3=C(C=C(C=C3O)Cl)Cl)CC4=C(C=C(C=C4)N(CCCl)CCCl)C

InChI

InChI=1S/C34H42Cl6N4O/c1-24-18-29(41(14-8-35)15-9-36)6-4-26(24)22-43-12-3-13-44(34(43)33-31(40)20-28(39)21-32(33)45)23-27-5-7-30(19-25(27)2)42(16-10-37)17-11-38/h4-7,18-21,34,45H,3,8-17,22-23H2,1-2H3