1-(4-nitrophenyl)-3-[1-(phenylmethyl)piperidin-1-ium-4-yl]urea

Systemtic Name: 1-(4-nitrophenyl)-3-[1-(phenylmethyl)piperidin-1-ium-4-yl]urea Openeye Name: 1-(1-benzylpiperidin-1-ium-4-yl)-3-(4-nitrophenyl)urea CAS Name: 1-(4-nitrophenyl)-3-[1-(phenylmethyl)-4-piperidin-1-iumyl]urea IUPAC Name: 1-(1-benzylpiperidin-1-ium-4-yl)-3-(4-nitrophenyl)urea Traditional Name: 1-(1-benzylpiperidin-1-ium-4-yl)-3-(4-nitrophenyl)urea Formula: C19H23N4O3+ MolecularWeight: 355.41092

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])CC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CCC1NC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])CC3=CC=CC=C3

InChI

InChI=1S/C19H22N4O3/c24-19(20-16-6-8-18(9-7-16)23(25)26)21-17-10-12-22(13-11-17)14-15-4-2-1-3-5-15/h1-9,17H,10-14H2,(H2,20,21,24)/p+1