2-(1-azanyl-2,2-dimethyl-7-oxidanylidene-azepin-1-ium-1-yl)ethanoic acid

Systemtic Name: 2-(1-azanyl-2,2-dimethyl-7-oxidanylidene-azepin-1-ium-1-yl)ethanoic acid Openeye Name: 2-(1-amino-2,2-dimethyl-7-oxo-azepin-1-ium-1-yl)acetic acid CAS Name: 2-(1-amino-2,2-dimethyl-7-oxo-1-azepin-1-iumyl)acetic acid IUPAC Name: 2-(1-amino-2,2-dimethyl-7-oxoazepin-1-ium-1-yl)acetic acid Traditional Name: 2-(1-amino-7-keto-2,2-dimethyl-azepin-1-ium-1-yl)acetic acid Formula: C10H15N2O3+ MolecularWeight: 211.2377

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=CC=CC(=O)[N+]1(CC(=O)O)N)C

Isomeric SMILES

CC1(C=CC=CC(=O)[N+]1(CC(=O)O)N)C

InChI

InChI=1S/C10H14N2O3/c1-10(2)6-4-3-5-8(13)12(10,11)7-9(14)15/h3-6H,7,11H2,1-2H3/p+1