2-azanyl-1-propan-2-yl-4,5,6,7-tetrahydro-1,3-diazepine-4-carboxylic acid

Systemtic Name: 2-azanyl-1-propan-2-yl-4,5,6,7-tetrahydro-1,3-diazepine-4-carboxylic acid Openeye Name: 2-amino-1-isopropyl-4,5,6,7-tetrahydro-1,3-diazepine-4-carboxylic acid CAS Name: 2-amino-1-propan-2-yl-4,5,6,7-tetrahydro-1,3-diazepine-4-carboxylic acid IUPAC Name: 2-amino-1-propan-2-yl-4,5,6,7-tetrahydro-1,3-diazepine-4-carboxylic acid Traditional Name: 2-amino-1-isopropyl-4,5,6,7-tetrahydro-1,3-diazepine-4-carboxylic acid Formula: C9H17N3O2 MolecularWeight: 199.25018

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCCC(N=C1N)C(=O)O

Isomeric SMILES

CC(C)N1CCCC(N=C1N)C(=O)O

InChI

InChI=1S/C9H17N3O2/c1-6(2)12-5-3-4-7(8(13)14)11-9(12)10/h6-7H,3-5H2,1-2H3,(H2,10,11)(H,13,14)