6-(phenoxymethylamino)-4-[(2,4,6-trimethylphenyl)amino]benzo[e]perimidin-7-one

Systemtic Name: 6-(phenoxymethylamino)-4-[(2,4,6-trimethylphenyl)amino]benzo[e]perimidin-7-one Openeye Name: 6-(phenoxymethylamino)-4-(2,4,6-trimethylanilino)benzo[e]perimidin-7-one CAS Name: 6-(phenoxymethylamino)-4-(2,4,6-trimethylanilino)-7-benzo[e]perimidinone IUPAC Name: 6-(phenoxymethylamino)-4-(2,4,6-trimethylanilino)benzo[e]perimidin-7-one Traditional Name: 4-mesidino-6-(phenoxymethylamino)benzo[e]perimidin-7-one Formula: C31H26N4O2 MolecularWeight: 486.56374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC2=C3C4=C(C(=C2)NCOC5=CC=CC=C5)C(=O)C6=CC=CC=C6C4=NC=N3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC2=C3C4=C(C(=C2)NCOC5=CC=CC=C5)C(=O)C6=CC=CC=C6C4=NC=N3)C

InChI

InChI=1S/C31H26N4O2/c1-18-13-19(2)28(20(3)14-18)35-25-15-24(34-17-37-21-9-5-4-6-10-21)26-27-29(32-16-33-30(25)27)22-11-7-8-12-23(22)31(26)36/h4-16,34-35H,17H2,1-3H3