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benzoic acid; methyl 3-(aziridin-1-yl)propanoate

benzoic acid; methyl 3-(aziridin-1-yl)propanoate

Systemtic Name:benzoic acid; methyl 3-(aziridin-1-yl)propanoate
Openeye Name:benzoic acid; methyl 3-(aziridin-1-yl)propanoate
CAS Name:3-(1-aziridinyl)propanoic acid methyl ester; benzoic acid
IUPAC Name:benzoic acid; methyl 3-(aziridin-1-yl)propanoate
Traditional Name:benzoic acid; 3-ethyleniminopropionic acid methyl ester
Formula: C13H17NO4
MolecularWeight: 251.27838
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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCN1CC1.C1=CC=C(C=C1)C(=O)O


Isomeric SMILES

COC(=O)CCN1CC1.C1=CC=C(C=C1)C(=O)O


InChI

InChI=1S/C7H6O2.C6H11NO2/c8-7(9)6-4-2-1-3-5-6;1-9-6(8)2-3-7-4-5-7/h1-5H,(H,8,9);2-5H2,1H3


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