1-(3-azanylpropyl)-3-(4-nitrophenyl)-1-(4-phenoxyphenyl)urea

Systemtic Name: 1-(3-azanylpropyl)-3-(4-nitrophenyl)-1-(4-phenoxyphenyl)urea Openeye Name: 1-(3-aminopropyl)-3-(4-nitrophenyl)-1-(4-phenoxyphenyl)urea CAS Name: 1-(3-aminopropyl)-3-(4-nitrophenyl)-1-(4-phenoxyphenyl)urea IUPAC Name: 1-(3-aminopropyl)-3-(4-nitrophenyl)-1-(4-phenoxyphenyl)urea Traditional Name: 1-(3-aminopropyl)-3-(4-nitrophenyl)-1-(4-phenoxyphenyl)urea Formula: C22H22N4O4 MolecularWeight: 406.43448

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)N(CCCN)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)N(CCCN)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H22N4O4/c23-15-4-16-25(22(27)24-17-7-9-19(10-8-17)26(28)29)18-11-13-21(14-12-18)30-20-5-2-1-3-6-20/h1-3,5-14H,4,15-16,23H2,(H,24,27)