N-[(1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-propyl]-1-ethyl-benzotriazole-5-carboxamide

Systemtic Name: N-[(1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-propyl]-1-ethyl-benzotriazole-5-carboxamide Openeye Name: N-[(1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-propyl]-1-ethyl-benzotriazole-5-carboxamide CAS Name: N-[(1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methylpropyl]-1-ethyl-5-benzotriazolecarboxamide IUPAC Name: N-[(1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methylpropyl]-1-ethylbenzotriazole-5-carboxamide Traditional Name: N-[(1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-propyl]-1-ethyl-benzotriazole-5-carboxamide Formula: C22H26N4O3 MolecularWeight: 394.46684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)NC(C3=CC4=C(C=C3)OCCCO4)C(C)C)N=N1

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)N[C@@H](C3=CC4=C(C=C3)OCCCO4)C(C)C)N=N1

InChI

InChI=1S/C22H26N4O3/c1-4-26-18-8-6-16(12-17(18)24-25-26)22(27)23-21(14(2)3)15-7-9-19-20(13-15)29-11-5-10-28-19/h6-9,12-14,21H,4-5,10-11H2,1-3H3,(H,23,27)/t21-/m1/s1