1-methyl-4-(3-methylbutylamino)piperidin-1-ium-4-carbonitrile

Systemtic Name: 1-methyl-4-(3-methylbutylamino)piperidin-1-ium-4-carbonitrile Openeye Name: 4-(isopentylamino)-1-methyl-piperidin-1-ium-4-carbonitrile CAS Name: 1-methyl-4-(3-methylbutylamino)-4-piperidin-1-iumcarbonitrile IUPAC Name: 1-methyl-4-(3-methylbutylamino)piperidin-1-ium-4-carbonitrile Traditional Name: 4-(isoamylamino)-1-methyl-piperidin-1-ium-4-carbonitrile Formula: C12H24N3+ MolecularWeight: 210.33906

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1(CC[NH+](CC1)C)C#N

Isomeric SMILES

CC(C)CCNC1(CC[NH+](CC1)C)C#N

InChI

InChI=1S/C12H23N3/c1-11(2)4-7-14-12(10-13)5-8-15(3)9-6-12/h11,14H,4-9H2,1-3H3/p+1