N-[3-[4-(3-cyanopropanoylamino)butyl]oxiran-2-yl]quinoline-2-carboxamide

Systemtic Name: N-[3-[4-(3-cyanopropanoylamino)butyl]oxiran-2-yl]quinoline-2-carboxamide Openeye Name: N-[3-[4-(3-cyanopropanoylamino)butyl]oxiran-2-yl]quinoline-2-carboxamide CAS Name: N-[3-[4-[(3-cyano-1-oxopropyl)amino]butyl]-2-oxiranyl]-2-quinolinecarboxamide IUPAC Name: N-[3-[4-(3-cyanopropanoylamino)butyl]oxiran-2-yl]quinoline-2-carboxamide Traditional Name: N-[3-[4-(3-cyanopropanoylamino)butyl]oxiran-2-yl]quinaldamide Formula: C20H22N4O3 MolecularWeight: 366.41368

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)C(=O)NC3C(O3)CCCCNC(=O)CCC#N

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)C(=O)NC3C(O3)CCCCNC(=O)CCC#N

InChI

InChI=1S/C20H22N4O3/c21-12-5-9-18(25)22-13-4-3-8-17-20(27-17)24-19(26)16-11-10-14-6-1-2-7-15(14)23-16/h1-2,6-7,10-11,17,20H,3-5,8-9,13H2,(H,22,25)(H,24,26)