4-[(9-chloranylbenzo[a]acridin-12-yl)amino]-2-(diethylaminomethyl)phenol

Systemtic Name: 4-[(9-chloranylbenzo[a]acridin-12-yl)amino]-2-(diethylaminomethyl)phenol Openeye Name: 4-[(9-chlorobenzo[a]acridin-12-yl)amino]-2-(diethylaminomethyl)phenol CAS Name: 4-[(9-chloro-12-benzo[a]acridinyl)amino]-2-(diethylaminomethyl)phenol IUPAC Name: 4-[(9-chlorobenzo[a]acridin-12-yl)amino]-2-(diethylaminomethyl)phenol Traditional Name: 4-[(9-chlorobenz[a]acridin-12-yl)amino]-2-(diethylaminomethyl)phenol Formula: C28H26ClN3O MolecularWeight: 455.97854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=C(C=CC(=C1)NC2=C3C(=NC4=C2C=CC(=C4)Cl)C=CC5=CC=CC=C53)O

Isomeric SMILES

CCN(CC)CC1=C(C=CC(=C1)NC2=C3C(=NC4=C2C=CC(=C4)Cl)C=CC5=CC=CC=C53)O

InChI

InChI=1S/C28H26ClN3O/c1-3-32(4-2)17-19-15-21(11-14-26(19)33)30-28-23-12-10-20(29)16-25(23)31-24-13-9-18-7-5-6-8-22(18)27(24)28/h5-16,33H,3-4,17H2,1-2H3,(H,30,31)