4,5-dihydro-1,2-oxazol-3-yl N-[(7-azanyl-3,4,5,6-tetrahydro-2H-azepin-2-yl)methyl]carbamate

Systemtic Name: 4,5-dihydro-1,2-oxazol-3-yl N-[(7-azanyl-3,4,5,6-tetrahydro-2H-azepin-2-yl)methyl]carbamate Openeye Name: 4,5-dihydroisoxazol-3-yl N-[(7-amino-3,4,5,6-tetrahydro-2H-azepin-2-yl)methyl]carbamate CAS Name: N-[(7-amino-3,4,5,6-tetrahydro-2H-azepin-2-yl)methyl]carbamic acid 4,5-dihydroisoxazol-3-yl ester IUPAC Name: 4,5-dihydro-1,2-oxazol-3-yl N-[(7-amino-3,4,5,6-tetrahydro-2H-azepin-2-yl)methyl]carbamate Traditional Name: N-[(7-amino-3,4,5,6-tetrahydro-2H-azepin-2-yl)methyl]carbamic acid 2-isoxazolin-3-yl ester Formula: C11H18N4O3 MolecularWeight: 254.28562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=NC(C1)CNC(=O)OC2=NOCC2)N

Isomeric SMILES

C1CCC(=NC(C1)CNC(=O)OC2=NOCC2)N

InChI

InChI=1S/C11H18N4O3/c12-9-4-2-1-3-8(14-9)7-13-11(16)18-10-5-6-17-15-10/h8H,1-7H2,(H2,12,14)(H,13,16)