butan-2-yl 4-[4-(aziridin-2-yl)butoxy]benzoate

Systemtic Name: butan-2-yl 4-[4-(aziridin-2-yl)butoxy]benzoate Openeye Name: sec-butyl 4-[4-(aziridin-2-yl)butoxy]benzoate CAS Name: 4-[4-(2-aziridinyl)butoxy]benzoic acid butan-2-yl ester IUPAC Name: butan-2-yl 4-[4-(aziridin-2-yl)butoxy]benzoate Traditional Name: 4-(4-ethylenimin-2-ylbutoxy)benzoic acid sec-butyl ester Formula: C17H25NO3 MolecularWeight: 291.3853

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC(=O)C1=CC=C(C=C1)OCCCCC2CN2

Isomeric SMILES

CCC(C)OC(=O)C1=CC=C(C=C1)OCCCCC2CN2

InChI

InChI=1S/C17H25NO3/c1-3-13(2)21-17(19)14-7-9-16(10-8-14)20-11-5-4-6-15-12-18-15/h7-10,13,15,18H,3-6,11-12H2,1-2H3