(2S)-2-(1,4-diazepan-4-ium-1-yl)-N-propan-2-yl-propanamide

Systemtic Name: (2S)-2-(1,4-diazepan-4-ium-1-yl)-N-propan-2-yl-propanamide Openeye Name: (2S)-2-(1,4-diazepan-4-ium-1-yl)-N-isopropyl-propanamide CAS Name: (2S)-2-(1,4-diazepan-4-ium-1-yl)-N-propan-2-ylpropanamide IUPAC Name: (2S)-2-(1,4-diazepan-4-ium-1-yl)-N-propan-2-ylpropanamide Traditional Name: (2S)-2-(1,4-diazepan-4-ium-1-yl)-N-isopropyl-propionamide Formula: C11H24N3O+ MolecularWeight: 214.32776

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C(C)N1CCC[NH2+]CC1

Isomeric SMILES

C[C@@H](C(=O)NC(C)C)N1CCC[NH2+]CC1

InChI

InChI=1S/C11H23N3O/c1-9(2)13-11(15)10(3)14-7-4-5-12-6-8-14/h9-10,12H,4-8H2,1-3H3,(H,13,15)/p+1/t10-/m0/s1