2-(2-nitrophenoxy)-N-[[1-(phenylmethyl)piperidin-1-ium-4-ylidene]amino]ethanamide

Systemtic Name: 2-(2-nitrophenoxy)-N-[[1-(phenylmethyl)piperidin-1-ium-4-ylidene]amino]ethanamide Openeye Name: N-[(1-benzylpiperidin-1-ium-4-ylidene)amino]-2-(2-nitrophenoxy)acetamide CAS Name: 2-(2-nitrophenoxy)-N-[[1-(phenylmethyl)-4-piperidin-1-iumylidene]amino]acetamide IUPAC Name: N-[(1-benzylpiperidin-1-ium-4-ylidene)amino]-2-(2-nitrophenoxy)acetamide Traditional Name: N-[(1-benzylpiperidin-1-ium-4-ylidene)amino]-2-(2-nitrophenoxy)acetamide Formula: C20H23N4O4+ MolecularWeight: 383.42102

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1=NNC(=O)COC2=CC=CC=C2[N+](=O)[O-])CC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CCC1=NNC(=O)COC2=CC=CC=C2[N+](=O)[O-])CC3=CC=CC=C3

InChI

InChI=1S/C20H22N4O4/c25-20(15-28-19-9-5-4-8-18(19)24(26)27)22-21-17-10-12-23(13-11-17)14-16-6-2-1-3-7-16/h1-9H,10-15H2,(H,22,25)/p+1