2-azanyl-4-[2,4-bis(oxidanylidene)-1-prop-2-enyl-piperidin-3-yl]-3-(hydroxymethyl)benzenecarbonitrile

Systemtic Name: 2-azanyl-4-[2,4-bis(oxidanylidene)-1-prop-2-enyl-piperidin-3-yl]-3-(hydroxymethyl)benzenecarbonitrile Openeye Name: 4-(1-allyl-2,4-dioxo-3-piperidyl)-2-amino-3-(hydroxymethyl)benzonitrile CAS Name: 2-amino-4-(2,4-dioxo-1-prop-2-enyl-3-piperidinyl)-3-(hydroxymethyl)benzonitrile IUPAC Name: 2-amino-4-(2,4-dioxo-1-prop-2-enylpiperidin-3-yl)-3-(hydroxymethyl)benzonitrile Traditional Name: 4-(1-allyl-2,4-diketo-3-piperidyl)-2-amino-3-methylol-benzonitrile Formula: C16H17N3O3 MolecularWeight: 299.32448

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1CCC(=O)C(C1=O)C2=C(C(=C(C=C2)C#N)N)CO

Isomeric SMILES

C=CCN1CCC(=O)C(C1=O)C2=C(C(=C(C=C2)C#N)N)CO

InChI

InChI=1S/C16H17N3O3/c1-2-6-19-7-5-13(21)14(16(19)22)11-4-3-10(8-17)15(18)12(11)9-20/h2-4,14,20H,1,5-7,9,18H2