4-(propanoylamino)-N-[(1-propan-2-ylpiperidin-1-ium-4-ylidene)amino]benzamide

Systemtic Name: 4-(propanoylamino)-N-[(1-propan-2-ylpiperidin-1-ium-4-ylidene)amino]benzamide Openeye Name: N-[(1-isopropylpiperidin-1-ium-4-ylidene)amino]-4-(propanoylamino)benzamide CAS Name: 4-(1-oxopropylamino)-N-[(1-propan-2-yl-4-piperidin-1-iumylidene)amino]benzamide IUPAC Name: 4-(propanoylamino)-N-[(1-propan-2-ylpiperidin-1-ium-4-ylidene)amino]benzamide Traditional Name: N-[(1-isopropylpiperidin-1-ium-4-ylidene)amino]-4-propionamido-benzamide Formula: C18H27N4O2+ MolecularWeight: 331.43258

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)C(=O)NN=C2CC[NH+](CC2)C(C)C

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C(=O)NN=C2CC[NH+](CC2)C(C)C

InChI

InChI=1S/C18H26N4O2/c1-4-17(23)19-15-7-5-14(6-8-15)18(24)21-20-16-9-11-22(12-10-16)13(2)3/h5-8,13H,4,9-12H2,1-3H3,(H,19,23)(H,21,24)/p+1