N-[3-[4-[bis(2-chloroethyl)amino]butoxy]phenyl]acridin-9-amine

Systemtic Name: N-[3-[4-[bis(2-chloroethyl)amino]butoxy]phenyl]acridin-9-amine Openeye Name: N-[3-[4-[bis(2-chloroethyl)amino]butoxy]phenyl]acridin-9-amine CAS Name: N-[3-[4-[bis(2-chloroethyl)amino]butoxy]phenyl]-9-acridinamine IUPAC Name: N-[3-[4-[bis(2-chloroethyl)amino]butoxy]phenyl]acridin-9-amine Traditional Name: 4-[3-(acridin-9-ylamino)phenoxy]butyl-bis(2-chloroethyl)amine Formula: C27H29Cl2N3O MolecularWeight: 482.44466

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NC4=CC(=CC=C4)OCCCCN(CCCl)CCCl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NC4=CC(=CC=C4)OCCCCN(CCCl)CCCl

InChI

InChI=1S/C27H29Cl2N3O/c28-14-17-32(18-15-29)16-5-6-19-33-22-9-7-8-21(20-22)30-27-23-10-1-3-12-25(23)31-26-13-4-2-11-24(26)27/h1-4,7-13,20H,5-6,14-19H2,(H,30,31)