1-[4-(1-oxidanidylpyridin-1-ium-4-yl)oxyphenyl]-3-(3-pyrrol-1-ylphenyl)urea

Systemtic Name: 1-[4-(1-oxidanidylpyridin-1-ium-4-yl)oxyphenyl]-3-(3-pyrrol-1-ylphenyl)urea Openeye Name: 1-[4-(1-oxidopyridin-1-ium-4-yl)oxyphenyl]-3-(3-pyrrol-1-ylphenyl)urea CAS Name: 1-[4-[(1-oxido-4-pyridin-1-iumyl)oxy]phenyl]-3-[3-(1-pyrrolyl)phenyl]urea IUPAC Name: 1-[4-(1-oxidopyridin-1-ium-4-yl)oxyphenyl]-3-(3-pyrrol-1-ylphenyl)urea Traditional Name: 1-[4-(1-oxidopyridin-1-ium-4-yl)oxyphenyl]-3-(3-pyrrol-1-ylphenyl)urea Formula: C22H18N4O3 MolecularWeight: 386.40332

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=C1)C2=CC(=CC=C2)NC(=O)NC3=CC=C(C=C3)OC4=CC=[N+](C=C4)[O-]

Isomeric SMILES

C1=CN(C=C1)C2=CC(=CC=C2)NC(=O)NC3=CC=C(C=C3)OC4=CC=[N+](C=C4)[O-]

InChI

InChI=1S/C22H18N4O3/c27-22(24-18-4-3-5-19(16-18)25-12-1-2-13-25)23-17-6-8-20(9-7-17)29-21-10-14-26(28)15-11-21/h1-16H,(H2,23,24,27)