1-[2-azanyl-4-(1,3-benzodioxol-5-ylamino)butanoyl]piperidine-2-carbonitrile

Systemtic Name: 1-[2-azanyl-4-(1,3-benzodioxol-5-ylamino)butanoyl]piperidine-2-carbonitrile Openeye Name: 1-[2-amino-4-(1,3-benzodioxol-5-ylamino)butanoyl]piperidine-2-carbonitrile CAS Name: 1-[2-amino-4-(1,3-benzodioxol-5-ylamino)-1-oxobutyl]-2-piperidinecarbonitrile IUPAC Name: 1-[2-amino-4-(1,3-benzodioxol-5-ylamino)butanoyl]piperidine-2-carbonitrile Traditional Name: 1-[2-amino-4-(1,3-benzodioxol-5-ylamino)butanoyl]pipecolinonitrile Formula: C17H22N4O3 MolecularWeight: 330.38158

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C#N)C(=O)C(CCNC2=CC3=C(C=C2)OCO3)N

Isomeric SMILES

C1CCN(C(C1)C#N)C(=O)C(CCNC2=CC3=C(C=C2)OCO3)N

InChI

InChI=1S/C17H22N4O3/c18-10-13-3-1-2-8-21(13)17(22)14(19)6-7-20-12-4-5-15-16(9-12)24-11-23-15/h4-5,9,13-14,20H,1-3,6-8,11,19H2