3-butyl-6,8-bis(butylaminomethyl)-2,4-dihydro-1,3-benzoxazine-5,7-diol

Systemtic Name: 3-butyl-6,8-bis(butylaminomethyl)-2,4-dihydro-1,3-benzoxazine-5,7-diol Openeye Name: 3-butyl-6,8-bis(butylaminomethyl)-2,4-dihydro-1,3-benzoxazine-5,7-diol CAS Name: 3-butyl-6,8-bis(butylaminomethyl)-2,4-dihydro-1,3-benzoxazine-5,7-diol IUPAC Name: 3-butyl-6,8-bis(butylaminomethyl)-2,4-dihydro-1,3-benzoxazine-5,7-diol Traditional Name: 3-butyl-6,8-bis(butylaminomethyl)-2,4-dihydro-1,3-benzoxazine-5,7-diol Formula: C22H39N3O3 MolecularWeight: 393.56336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNCC1=C(C2=C(C(=C1O)CNCCCC)OCN(C2)CCCC)O

Isomeric SMILES

CCCCNCC1=C(C2=C(C(=C1O)CNCCCC)OCN(C2)CCCC)O

InChI

InChI=1S/C22H39N3O3/c1-4-7-10-23-13-17-20(26)18(14-24-11-8-5-2)22-19(21(17)27)15-25(16-28-22)12-9-6-3/h23-24,26-27H,4-16H2,1-3H3