1-(isocyanatomethyl)-4-(4-nitrophenyl)benzene

Systemtic Name: 1-(isocyanatomethyl)-4-(4-nitrophenyl)benzene Openeye Name: 1-(isocyanatomethyl)-4-(4-nitrophenyl)benzene CAS Name: 1-(isocyanatomethyl)-4-(4-nitrophenyl)benzene IUPAC Name: 1-(isocyanatomethyl)-4-(4-nitrophenyl)benzene Traditional Name: 1-(isocyanatomethyl)-4-(4-nitrophenyl)benzene Formula: C14H10N2O3 MolecularWeight: 254.2408

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN=C=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CN=C=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H10N2O3/c17-10-15-9-11-1-3-12(4-2-11)13-5-7-14(8-6-13)16(18)19/h1-8H,9H2