9-[[4-[bis(2-chloroethyl)amino]phenyl]carbamoylamino]-N-methyl-acridine-4-carboxamide

Systemtic Name: 9-[[4-[bis(2-chloroethyl)amino]phenyl]carbamoylamino]-N-methyl-acridine-4-carboxamide Openeye Name: 9-[[4-[bis(2-chloroethyl)amino]phenyl]carbamoylamino]-N-methyl-acridine-4-carboxamide CAS Name: 9-[[[4-[bis(2-chloroethyl)amino]anilino]-oxomethyl]amino]-N-methyl-4-acridinecarboxamide IUPAC Name: 9-[[4-[bis(2-chloroethyl)amino]phenyl]carbamoylamino]-N-methylacridine-4-carboxamide Traditional Name: 9-[[4-[bis(2-chloroethyl)amino]phenyl]carbamoylamino]-N-methyl-acridine-4-carboxamide Formula: C26H25Cl2N5O2 MolecularWeight: 510.415

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=CC2=C(C3=CC=CC=C3N=C21)NC(=O)NC4=CC=C(C=C4)N(CCCl)CCCl

Isomeric SMILES

CNC(=O)C1=CC=CC2=C(C3=CC=CC=C3N=C21)NC(=O)NC4=CC=C(C=C4)N(CCCl)CCCl

InChI

InChI=1S/C26H25Cl2N5O2/c1-29-25(34)21-7-4-6-20-23(19-5-2-3-8-22(19)31-24(20)21)32-26(35)30-17-9-11-18(12-10-17)33(15-13-27)16-14-28/h2-12H,13-16H2,1H3,(H,29,34)(H2,30,31,32,35)