(2-methyl-5-prop-1-en-2-yl-cyclopenten-1-yl)methyl 4-nitrobenzoate

Systemtic Name: (2-methyl-5-prop-1-en-2-yl-cyclopenten-1-yl)methyl 4-nitrobenzoate Openeye Name: (5-isopropenyl-2-methyl-cyclopenten-1-yl)methyl 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [2-methyl-5-(1-methylethenyl)-1-cyclopentenyl]methyl ester IUPAC Name: (2-methyl-5-prop-1-en-2-ylcyclopenten-1-yl)methyl 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid (5-isopropenyl-2-methyl-cyclopenten-1-yl)methyl ester Formula: C17H19NO4 MolecularWeight: 301.33706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CC1)C(=C)C)COC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(CC1)C(=C)C)COC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H19NO4/c1-11(2)15-9-4-12(3)16(15)10-22-17(19)13-5-7-14(8-6-13)18(20)21/h5-8,15H,1,4,9-10H2,2-3H3