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

Systemtic Name: 1-(3-nitrophenyl)-3-[2-[1-(phenylmethyl)piperidin-4-yl]ethyl]urea Openeye Name: 1-[2-(1-benzyl-4-piperidyl)ethyl]-3-(3-nitrophenyl)urea CAS Name: 1-(3-nitrophenyl)-3-[2-[1-(phenylmethyl)-4-piperidinyl]ethyl]urea IUPAC Name: 1-[2-(1-benzylpiperidin-4-yl)ethyl]-3-(3-nitrophenyl)urea Traditional Name: 1-[2-(1-benzyl-4-piperidyl)ethyl]-3-(3-nitrophenyl)urea Formula: C21H26N4O3 MolecularWeight: 382.45614

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CCNC(=O)NC2=CC(=CC=C2)[N+](=O)[O-])CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1CCNC(=O)NC2=CC(=CC=C2)[N+](=O)[O-])CC3=CC=CC=C3

InChI

InChI=1S/C21H26N4O3/c26-21(23-19-7-4-8-20(15-19)25(27)28)22-12-9-17-10-13-24(14-11-17)16-18-5-2-1-3-6-18/h1-8,15,17H,9-14,16H2,(H2,22,23,26)