3-azanyl-5-[(7-azanyl-3,4,5,6-tetrahydro-2H-azepin-2-yl)methyl]oxolan-2-one

Systemtic Name: 3-azanyl-5-[(7-azanyl-3,4,5,6-tetrahydro-2H-azepin-2-yl)methyl]oxolan-2-one Openeye Name: 3-amino-5-[(7-amino-3,4,5,6-tetrahydro-2H-azepin-2-yl)methyl]tetrahydrofuran-2-one CAS Name: 3-amino-5-[(7-amino-3,4,5,6-tetrahydro-2H-azepin-2-yl)methyl]-2-oxolanone IUPAC Name: 3-amino-5-[(7-amino-3,4,5,6-tetrahydro-2H-azepin-2-yl)methyl]oxolan-2-one Traditional Name: 3-amino-5-[(7-amino-3,4,5,6-tetrahydro-2H-azepin-2-yl)methyl]tetrahydrofuran-2-one Formula: C11H19N3O2 MolecularWeight: 225.28746

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=NC(C1)CC2CC(C(=O)O2)N)N

Isomeric SMILES

C1CCC(=NC(C1)CC2CC(C(=O)O2)N)N

InChI

InChI=1S/C11H19N3O2/c12-9-6-8(16-11(9)15)5-7-3-1-2-4-10(13)14-7/h7-9H,1-6,12H2,(H2,13,14)