hexyl N-[4-(1H-imidazol-5-ylmethyl)-2,3-dihydro-1,4-benzoxazin-6-yl]-N-methyl-carbamate

Systemtic Name: hexyl N-[4-(1H-imidazol-5-ylmethyl)-2,3-dihydro-1,4-benzoxazin-6-yl]-N-methyl-carbamate Openeye Name: hexyl N-[4-(1H-imidazol-5-ylmethyl)-2,3-dihydro-1,4-benzoxazin-6-yl]-N-methyl-carbamate CAS Name: N-[4-(1H-imidazol-5-ylmethyl)-2,3-dihydro-1,4-benzoxazin-6-yl]-N-methylcarbamic acid hexyl ester IUPAC Name: hexyl N-[4-(1H-imidazol-5-ylmethyl)-2,3-dihydro-1,4-benzoxazin-6-yl]-N-methylcarbamate Traditional Name: N-[4-(1H-imidazol-5-ylmethyl)-2,3-dihydro-1,4-benzoxazin-6-yl]-N-methyl-carbamic acid hexyl ester Formula: C20H28N4O3 MolecularWeight: 372.46132

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)N(C)C1=CC2=C(C=C1)OCCN2CC3=CN=CN3

Isomeric SMILES

CCCCCCOC(=O)N(C)C1=CC2=C(C=C1)OCCN2CC3=CN=CN3

InChI

InChI=1S/C20H28N4O3/c1-3-4-5-6-10-27-20(25)23(2)17-7-8-19-18(12-17)24(9-11-26-19)14-16-13-21-15-22-16/h7-8,12-13,15H,3-6,9-11,14H2,1-2H3,(H,21,22)