5-(cyclopropylmethyl)-1-[(5-methyl-2-oxidanylidene-1,3-dioxol-4-yl)methyl]azepane-2-carboxylic acid

Systemtic Name: 5-(cyclopropylmethyl)-1-[(5-methyl-2-oxidanylidene-1,3-dioxol-4-yl)methyl]azepane-2-carboxylic acid Openeye Name: 5-(cyclopropylmethyl)-1-[(5-methyl-2-oxo-1,3-dioxol-4-yl)methyl]azepane-2-carboxylic acid CAS Name: 5-(cyclopropylmethyl)-1-[(5-methyl-2-oxo-1,3-dioxol-4-yl)methyl]-2-azepanecarboxylic acid IUPAC Name: 5-(cyclopropylmethyl)-1-[(5-methyl-2-oxo-1,3-dioxol-4-yl)methyl]azepane-2-carboxylic acid Traditional Name: 5-(cyclopropylmethyl)-1-[(2-keto-5-methyl-1,3-dioxol-4-yl)methyl]azepane-2-carboxylic acid Formula: C16H23NO5 MolecularWeight: 309.35752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=O)O1)CN2CCC(CCC2C(=O)O)CC3CC3

Isomeric SMILES

CC1=C(OC(=O)O1)CN2CCC(CCC2C(=O)O)CC3CC3

InChI

InChI=1S/C16H23NO5/c1-10-14(22-16(20)21-10)9-17-7-6-12(8-11-2-3-11)4-5-13(17)15(18)19/h11-13H,2-9H2,1H3,(H,18,19)