3-(aminomethyl)-4-imidazol-1-yl-butan-2-one

Systemtic Name: 3-(aminomethyl)-4-imidazol-1-yl-butan-2-one Openeye Name: 3-(aminomethyl)-4-imidazol-1-yl-butan-2-one CAS Name: 3-(aminomethyl)-4-(1-imidazolyl)-2-butanone IUPAC Name: 3-(aminomethyl)-4-imidazol-1-ylbutan-2-one Traditional Name: 3-(aminomethyl)-4-imidazol-1-yl-butan-2-one Formula: C8H13N3O MolecularWeight: 167.20832

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CN)CN1C=CN=C1

Isomeric SMILES

CC(=O)C(CN)CN1C=CN=C1

InChI

InChI=1S/C8H13N3O/c1-7(12)8(4-9)5-11-3-2-10-6-11/h2-3,6,8H,4-5,9H2,1H3