2-(3-methylbutyl)-6,7,8,9-tetrahydro-5H-pyridazino[3,4-d]azepin-3-one

Systemtic Name: 2-(3-methylbutyl)-6,7,8,9-tetrahydro-5H-pyridazino[3,4-d]azepin-3-one Openeye Name: 2-isopentyl-6,7,8,9-tetrahydro-5H-pyridazino[3,4-d]azepin-3-one CAS Name: 2-(3-methylbutyl)-6,7,8,9-tetrahydro-5H-pyridazino[3,4-d]azepin-3-one IUPAC Name: 2-(3-methylbutyl)-6,7,8,9-tetrahydro-5H-pyridazino[3,4-d]azepin-3-one Traditional Name: 2-isoamyl-6,7,8,9-tetrahydro-5H-pyridazin[3,4-d]azepin-3-one Formula: C13H21N3O MolecularWeight: 235.32534

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C=C2CCNCCC2=N1

Isomeric SMILES

CC(C)CCN1C(=O)C=C2CCNCCC2=N1

InChI

InChI=1S/C13H21N3O/c1-10(2)5-8-16-13(17)9-11-3-6-14-7-4-12(11)15-16/h9-10,14H,3-8H2,1-2H3