1-[4-(3-azanyl-1,2-benzoxazol-4-yl)phenyl]-3-(3-nitrophenyl)urea

Systemtic Name: 1-[4-(3-azanyl-1,2-benzoxazol-4-yl)phenyl]-3-(3-nitrophenyl)urea Openeye Name: 1-[4-(3-amino-1,2-benzoxazol-4-yl)phenyl]-3-(3-nitrophenyl)urea CAS Name: 1-[4-(3-amino-1,2-benzoxazol-4-yl)phenyl]-3-(3-nitrophenyl)urea IUPAC Name: 1-[4-(3-amino-1,2-benzoxazol-4-yl)phenyl]-3-(3-nitrophenyl)urea Traditional Name: 1-[4-(3-aminoindoxazen-4-yl)phenyl]-3-(3-nitrophenyl)urea Formula: C20H15N5O4 MolecularWeight: 389.3642

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])NC(=O)NC2=CC=C(C=C2)C3=C4C(=CC=C3)ON=C4N

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])NC(=O)NC2=CC=C(C=C2)C3=C4C(=CC=C3)ON=C4N

InChI

InChI=1S/C20H15N5O4/c21-19-18-16(5-2-6-17(18)29-24-19)12-7-9-13(10-8-12)22-20(26)23-14-3-1-4-15(11-14)25(27)28/h1-11H,(H2,21,24)(H2,22,23,26)