4-(benzo[c]acridin-7-ylamino)-2-[bis(2-chloroethyl)aminomethyl]phenol

Systemtic Name: 4-(benzo[c]acridin-7-ylamino)-2-[bis(2-chloroethyl)aminomethyl]phenol Openeye Name: 4-(benzo[c]acridin-7-ylamino)-2-[bis(2-chloroethyl)aminomethyl]phenol CAS Name: 4-(7-benzo[c]acridinylamino)-2-[bis(2-chloroethyl)aminomethyl]phenol IUPAC Name: 4-(benzo[c]acridin-7-ylamino)-2-[bis(2-chloroethyl)aminomethyl]phenol Traditional Name: 4-(benz[c]acridin-7-ylamino)-2-[bis(2-chloroethyl)aminomethyl]phenol Formula: C28H25Cl2N3O MolecularWeight: 490.4236

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=C(C4=CC=CC=C4N=C32)NC5=CC(=C(C=C5)O)CN(CCCl)CCCl

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=C(C4=CC=CC=C4N=C32)NC5=CC(=C(C=C5)O)CN(CCCl)CCCl

InChI

InChI=1S/C28H25Cl2N3O/c29-13-15-33(16-14-30)18-20-17-21(10-12-26(20)34)31-28-23-7-3-4-8-25(23)32-27-22-6-2-1-5-19(22)9-11-24(27)28/h1-12,17,34H,13-16,18H2,(H,31,32)