(4-nitro-4-propan-2-yl-cyclohexa-2,5-dien-1-yl)-phenyl-methanone

Systemtic Name: (4-nitro-4-propan-2-yl-cyclohexa-2,5-dien-1-yl)-phenyl-methanone Openeye Name: (4-isopropyl-4-nitro-cyclohexa-2,5-dien-1-yl)-phenyl-methanone CAS Name: (4-nitro-4-propan-2-yl-1-cyclohexa-2,5-dienyl)-phenylmethanone IUPAC Name: (4-nitro-4-propan-2-ylcyclohexa-2,5-dien-1-yl)-phenylmethanone Traditional Name: (4-isopropyl-4-nitro-cyclohexa-2,5-dien-1-yl)-phenyl-methanone Formula: C16H17NO3 MolecularWeight: 271.31108

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17NO3/c1-12(2)16(17(19)20)10-8-14(9-11-16)15(18)13-6-4-3-5-7-13/h3-12,14H,1-2H3