3-(4-nitrophenyl)-1-(4-phenoxyphenyl)-1-[3-(phenylcarbamoylamino)propyl]urea

Systemtic Name: 3-(4-nitrophenyl)-1-(4-phenoxyphenyl)-1-[3-(phenylcarbamoylamino)propyl]urea Openeye Name: 3-(4-nitrophenyl)-1-(4-phenoxyphenyl)-1-[3-(phenylcarbamoylamino)propyl]urea CAS Name: 1-[3-[[anilino(oxo)methyl]amino]propyl]-3-(4-nitrophenyl)-1-(4-phenoxyphenyl)urea IUPAC Name: 3-(4-nitrophenyl)-1-(4-phenoxyphenyl)-1-[3-(phenylcarbamoylamino)propyl]urea Traditional Name: 3-(4-nitrophenyl)-1-(4-phenoxyphenyl)-1-[3-(phenylcarbamoylamino)propyl]urea Formula: C29H27N5O5 MolecularWeight: 525.55518

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)NCCCN(C2=CC=C(C=C2)OC3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)NCCCN(C2=CC=C(C=C2)OC3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C29H27N5O5/c35-28(31-22-8-3-1-4-9-22)30-20-7-21-33(29(36)32-23-12-14-25(15-13-23)34(37)38)24-16-18-27(19-17-24)39-26-10-5-2-6-11-26/h1-6,8-19H,7,20-21H2,(H,32,36)(H2,30,31,35)