6-[[2,5-bis(oxidanyl)phenyl]methylamino]-3-phenethyl-1,3-benzoxazine-2,4-dione

Systemtic Name: 6-[[2,5-bis(oxidanyl)phenyl]methylamino]-3-phenethyl-1,3-benzoxazine-2,4-dione Openeye Name: 6-[(2,5-dihydroxyphenyl)methylamino]-3-phenethyl-1,3-benzoxazine-2,4-dione CAS Name: 6-[(2,5-dihydroxyphenyl)methylamino]-3-phenethyl-1,3-benzoxazine-2,4-dione IUPAC Name: 6-[(2,5-dihydroxyphenyl)methylamino]-3-phenethyl-1,3-benzoxazine-2,4-dione Traditional Name: 6-[(2,5-dihydroxybenzyl)amino]-3-phenethyl-1,3-benzoxazine-2,4-quinone Formula: C23H20N2O5 MolecularWeight: 404.4153

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C(=O)C3=C(C=CC(=C3)NCC4=C(C=CC(=C4)O)O)OC2=O

Isomeric SMILES

C1=CC=C(C=C1)CCN2C(=O)C3=C(C=CC(=C3)NCC4=C(C=CC(=C4)O)O)OC2=O

InChI

InChI=1S/C23H20N2O5/c26-18-7-8-20(27)16(12-18)14-24-17-6-9-21-19(13-17)22(28)25(23(29)30-21)11-10-15-4-2-1-3-5-15/h1-9,12-13,24,26-27H,10-11,14H2