6-[[[2-(4-methylphenyl)-1,3-benzoxazol-5-yl]amino]methylidene]-2-nitro-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[[2-(4-methylphenyl)-1,3-benzoxazol-5-yl]amino]methylidene]-2-nitro-cyclohexa-2,4-dien-1-one Openeye Name: 2-nitro-6-[[[2-(p-tolyl)-1,3-benzoxazol-5-yl]amino]methylene]cyclohexa-2,4-dien-1-one CAS Name: 6-[[[2-(4-methylphenyl)-1,3-benzoxazol-5-yl]amino]methylidene]-2-nitro-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[[2-(4-methylphenyl)-1,3-benzoxazol-5-yl]amino]methylidene]-2-nitrocyclohexa-2,4-dien-1-one Traditional Name: 2-nitro-6-[[[2-(p-tolyl)-1,3-benzoxazol-5-yl]amino]methylene]cyclohexa-2,4-dien-1-one Formula: C21H15N3O4 MolecularWeight: 373.3615

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC=C4C=CC=C(C4=O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC=C4C=CC=C(C4=O)[N+](=O)[O-]

InChI

InChI=1S/C21H15N3O4/c1-13-5-7-14(8-6-13)21-23-17-11-16(9-10-19(17)28-21)22-12-15-3-2-4-18(20(15)25)24(26)27/h2-12,22H,1H3