1-[2-(4-methoxyphenyl)-2-piperidin-1-yl-ethyl]-3-(2-nitrophenyl)urea

Systemtic Name: 1-[2-(4-methoxyphenyl)-2-piperidin-1-yl-ethyl]-3-(2-nitrophenyl)urea Openeye Name: 1-[2-(4-methoxyphenyl)-2-(1-piperidyl)ethyl]-3-(2-nitrophenyl)urea CAS Name: 1-[2-(4-methoxyphenyl)-2-(1-piperidinyl)ethyl]-3-(2-nitrophenyl)urea IUPAC Name: 1-[2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]-3-(2-nitrophenyl)urea Traditional Name: 1-[2-(4-methoxyphenyl)-2-piperidino-ethyl]-3-(2-nitrophenyl)urea Formula: C21H26N4O4 MolecularWeight: 398.45554

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC(=O)NC2=CC=CC=C2[N+](=O)[O-])N3CCCCC3

Isomeric SMILES

COC1=CC=C(C=C1)C(CNC(=O)NC2=CC=CC=C2[N+](=O)[O-])N3CCCCC3

InChI

InChI=1S/C21H26N4O4/c1-29-17-11-9-16(10-12-17)20(24-13-5-2-6-14-24)15-22-21(26)23-18-7-3-4-8-19(18)25(27)28/h3-4,7-12,20H,2,5-6,13-15H2,1H3,(H2,22,23,26)