4-[3-(2-phenylaziridin-1-yl)butyl]benzamide dihydrochloride

Systemtic Name: 4-[3-(2-phenylaziridin-1-yl)butyl]benzamide dihydrochloride Openeye Name: 4-[3-(2-phenylaziridin-1-yl)butyl]benzamide dihydrochloride CAS Name: 4-[3-(2-phenyl-1-aziridinyl)butyl]benzamide dihydrochloride IUPAC Name: 4-[3-(2-phenylaziridin-1-yl)butyl]benzamide dihydrochloride Traditional Name: 4-[3-(2-phenylethylenimin-1-yl)butyl]benzamide dihydrochloride Formula: C19H24Cl2N2O MolecularWeight: 367.31266

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=C(C=C1)C(=O)N)N2CC2C3=CC=CC=C3.Cl.Cl

Isomeric SMILES

CC(CCC1=CC=C(C=C1)C(=O)N)N2CC2C3=CC=CC=C3.Cl.Cl

InChI

InChI=1S/C19H22N2O.2ClH/c1-14(21-13-18(21)16-5-3-2-4-6-16)7-8-15-9-11-17(12-10-15)19(20)22;;/h2-6,9-12,14,18H,7-8,13H2,1H3,(H2,20,22);2*1H